CHEBI:119831 - 2-(4-chlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

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ChEBI Name 2-(4-chlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
ChEBI ID CHEBI:119831
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C16H14ClNO4S
Net Charge 0
Average Mass 351.806
Monoisotopic Mass 351.03321
InChI InChI=1S/C16H14ClNO4S/c17-13-5-7-14(8-6-13)23(21,22)18-10-12-4-2-1-3-11(12)9-15(18)16(19)20/h1-8,15H,9-10H2,(H,19,20)
InChIKey MWFNHAUXOMDUFH-UHFFFAOYSA-N
SMILES C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)Cl)C(=O)O
ChEBI Ontology
Outgoing 2-(4-chlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid (CHEBI:119831) is a isoquinolines (CHEBI:24922)
Manual Xref Database
LSM-31275 LINCS
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