2-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]butanedioic acid

Systemtic Name: 2-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]butanedioic acid Openeye Name: 2-[(1-benzyl-2-hydroxy-2-oxo-ethyl)amino]butanedioic acid CAS Name: 2-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]butanedioic acid IUPAC Name: 2-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]butanedioic acid Traditional Name: 2-[(1-benzyl-2-hydroxy-2-keto-ethyl)amino]succinic acid Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO6/c15-11(16)7-10(13(19)20)14-9(12(17)18)6-8-4-2-1-3-5-8/h1-5,9-10,14H,6-7H2,(H,15,16)(H,17,18)(H,19,20)