CHEBI:105458 - 4-[3-(4-methoxyanilino)-3-oxopropyl]-1-piperazinecarboxylic acid ethyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-[3-(4-methoxyanilino)-3-oxopropyl]-1-piperazinecarboxylic acid ethyl ester
ChEBI ID CHEBI:105458
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H25N3O4
Net Charge 0
Average Mass 335.399
Monoisotopic Mass 335.18451
InChI InChI=1S/C17H25N3O4/c1-3-24-17(22)20-12-10-19(11-13-20)9-8-16(21)18-14-4-6-15(23-2)7-5-14/h4-7H,3,8-13H2,1-2H3,(H,18,21)
InChIKey QOGMSGDSEDXMQN-UHFFFAOYSA-N
SMILES CCOC(=O)N1CCN(CC1)CCC(=O)NC2=CC=C(C=C2)OC
ChEBI Ontology
Outgoing 4-[3-(4-methoxyanilino)-3-oxopropyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:105458) has functional parent β-amino acid (CHEBI:33706)
4-[3-(4-methoxyanilino)-3-oxopropyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:105458) is a organonitrogen compound (CHEBI:35352)
4-[3-(4-methoxyanilino)-3-oxopropyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:105458) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
LSM-16821 LINCS
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