(2S)-2-[(4-acetamidophenyl)amino]pentanedioic acid

Systemtic Name: (2S)-2-[(4-acetamidophenyl)amino]pentanedioic acid Openeye Name: (2S)-2-(4-acetamidoanilino)pentanedioic acid CAS Name: (2S)-2-(4-acetamidoanilino)pentanedioic acid IUPAC Name: (2S)-2-(4-acetamidoanilino)pentanedioic acid Traditional Name: (2S)-2-(4-acetamidoanilino)glutaric acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N[C@@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C13H16N2O5/c1-8(16)14-9-2-4-10(5-3-9)15-11(13(19)20)6-7-12(17)18/h2-5,11,15H,6-7H2,1H3,(H,14,16)(H,17,18)(H,19,20)/t11-/m0/s1