1-[2-[(3-azanyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[(3-azanyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(3-amino-4-methoxy-anilino)-2-oxo-ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(3-amino-4-methoxyanilino)-2-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(3-amino-4-methoxyanilino)-2-oxoethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(3-amino-4-methoxy-anilino)-2-keto-ethyl]isonipecotic acid Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)O)N

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)O)N

InChI

InChI=1S/C15H21N3O4/c1-22-13-3-2-11(8-12(13)16)17-14(19)9-18-6-4-10(5-7-18)15(20)21/h2-3,8,10H,4-7,9,16H2,1H3,(H,17,19)(H,20,21)