3-[(1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]aziridine-2-carboxylic acid

Systemtic Name: 3-[(1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]aziridine-2-carboxylic acid Openeye Name: 3-[(1-benzyl-2-oxo-ethyl)carbamoyl]aziridine-2-carboxylic acid CAS Name: 3-[oxo-[(1-oxo-3-phenylpropan-2-yl)amino]methyl]-2-aziridinecarboxylic acid IUPAC Name: 3-[(1-oxo-3-phenylpropan-2-yl)carbamoyl]aziridine-2-carboxylic acid Traditional Name: 3-[(1-benzyl-2-keto-ethyl)carbamoyl]ethylenimine-2-carboxylic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C=O)NC(=O)C2C(N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C=O)NC(=O)C2C(N2)C(=O)O

InChI

InChI=1S/C13H14N2O4/c16-7-9(6-8-4-2-1-3-5-8)14-12(17)10-11(15-10)13(18)19/h1-5,7,9-11,15H,6H2,(H,14,17)(H,18,19)