4-[(2-methoxycarbonylphenyl)amino]-4-oxidanylidene-2-piperazin-1-yl-butanoic acid

Systemtic Name: 4-[(2-methoxycarbonylphenyl)amino]-4-oxidanylidene-2-piperazin-1-yl-butanoic acid Openeye Name: 4-(2-methoxycarbonylanilino)-4-oxo-2-piperazin-1-yl-butanoic acid CAS Name: 4-(2-methoxycarbonylanilino)-4-oxo-2-(1-piperazinyl)butanoic acid IUPAC Name: 4-(2-methoxycarbonylanilino)-4-oxo-2-piperazin-1-ylbutanoic acid Traditional Name: 4-(2-carbomethoxyanilino)-4-keto-2-piperazino-butyric acid Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CC(C(=O)O)N2CCNCC2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CC(C(=O)O)N2CCNCC2

InChI

InChI=1S/C16H21N3O5/c1-24-16(23)11-4-2-3-5-12(11)18-14(20)10-13(15(21)22)19-8-6-17-7-9-19/h2-5,13,17H,6-10H2,1H3,(H,18,20)(H,21,22)