(2S)-2-[(2-methanoylphenyl)carbonylamino]pentanedioic acid

Systemtic Name: (2S)-2-[(2-methanoylphenyl)carbonylamino]pentanedioic acid Openeye Name: (2S)-2-[(2-formylbenzoyl)amino]pentanedioic acid CAS Name: (2S)-2-[[(2-formylphenyl)-oxomethyl]amino]pentanedioic acid IUPAC Name: (2S)-2-[(2-formylbenzoyl)amino]pentanedioic acid Traditional Name: (2S)-2-[(2-formylbenzoyl)amino]glutaric acid Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO6/c15-7-8-3-1-2-4-9(8)12(18)14-10(13(19)20)5-6-11(16)17/h1-4,7,10H,5-6H2,(H,14,18)(H,16,17)(H,19,20)/t10-/m0/s1