2-(2-benzamidoethanoylamino)propanedioic acid

Systemtic Name: 2-(2-benzamidoethanoylamino)propanedioic acid Openeye Name: 2-[(2-benzamidoacetyl)amino]propanedioic acid CAS Name: 2-[(2-benzamido-1-oxoethyl)amino]propanedioic acid IUPAC Name: 2-[(2-benzamidoacetyl)amino]propanedioic acid Traditional Name: 2-(hippuroylamino)malonic acid Formula: C12H12N2O6 MolecularWeight: 280.23348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O6/c15-8(14-9(11(17)18)12(19)20)6-13-10(16)7-4-2-1-3-5-7/h1-5,9H,6H2,(H,13,16)(H,14,15)(H,17,18)(H,19,20)