null CDK 0225161901 null 25 27 0 0 0 0 0 0 0 0999 V2000 4.2135 3.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2135 2.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9279 1.9354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 1.9354 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7845 0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0701 1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3556 0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6411 1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6411 1.9354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3556 2.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0701 1.9354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1435 2.1904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6284 1.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1435 0.8555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2135 0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9279 1.1104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2135 -0.1271 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -0.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -1.3646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2135 -1.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2135 -2.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -3.0146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7845 -2.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7845 -1.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 4 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 7 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 9 1 0 0 0 0 5 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 20 1 0 0 0 0 M END > CHEBI:116501 > 2-acetamido-3-(1,3-benzodioxol-5-yl)-N-(phenylmethyl)-2-propenamide > 2 > C19H18N2O4 > 338.358 > 338.12666 > 0 > CC(=O)NC(=CC1=CC2=C(C=C1)OCO2)C(=O)NCC3=CC=CC=C3 > InChI=1S/C19H18N2O4/c1-13(22)21-16(19(23)20-11-14-5-3-2-4-6-14)9-15-7-8-17-18(10-15)25-12-24-17/h2-10H,11-12H2,1H3,(H,20,23)(H,21,22) > BDWXGEIHUXSMQS-UHFFFAOYSA-N > LSM-27956 $$$$