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

Systemtic Name: 4-[(2-methoxycarbonylphenyl)amino]-2-(4-methylpiperazin-1-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-methoxycarbonylanilino)-2-(4-methylpiperazin-1-yl)-4-oxo-butanoic acid CAS Name: 4-(2-methoxycarbonylanilino)-2-(4-methyl-1-piperazinyl)-4-oxobutanoic acid IUPAC Name: 4-(2-methoxycarbonylanilino)-2-(4-methylpiperazin-1-yl)-4-oxobutanoic acid Traditional Name: 4-(2-carbomethoxyanilino)-4-keto-2-(4-methylpiperazino)butyric acid Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CC(=O)NC2=CC=CC=C2C(=O)OC)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(CC(=O)NC2=CC=CC=C2C(=O)OC)C(=O)O

InChI

InChI=1S/C17H23N3O5/c1-19-7-9-20(10-8-19)14(16(22)23)11-15(21)18-13-6-4-3-5-12(13)17(24)25-2/h3-6,14H,7-11H2,1-2H3,(H,18,21)(H,22,23)