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

Systemtic Name: (2R)-4-[(4-methoxyphenyl)amino]-2-(4-methylpiperazin-1-yl)-4-oxidanylidene-butanoic acid Openeye Name: (2R)-4-(4-methoxyanilino)-2-(4-methylpiperazin-1-yl)-4-oxo-butanoic acid CAS Name: (2R)-4-(4-methoxyanilino)-2-(4-methyl-1-piperazinyl)-4-oxobutanoic acid IUPAC Name: (2R)-4-(4-methoxyanilino)-2-(4-methylpiperazin-1-yl)-4-oxobutanoic acid Traditional Name: (2R)-4-keto-2-(4-methylpiperazino)-4-(p-anisidino)butyric acid Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CC(=O)NC2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CN1CCN(CC1)[C@H](CC(=O)NC2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C16H23N3O4/c1-18-7-9-19(10-8-18)14(16(21)22)11-15(20)17-12-3-5-13(23-2)6-4-12/h3-6,14H,7-11H2,1-2H3,(H,17,20)(H,21,22)/t14-/m1/s1