(2S)-2-[(2-oxidanylidene-1,3-dihydroimidazol-4-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[(2-oxidanylidene-1,3-dihydroimidazol-4-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[(2-oxo-1,3-dihydroimidazole-4-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[oxo-(2-oxo-1,3-dihydroimidazol-4-yl)methyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[(2-oxo-1,3-dihydroimidazole-4-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(2-keto-4-imidazoline-4-carbonyl)amino]-3-phenyl-propionate Formula: C13H12N3O4- MolecularWeight: 274.25208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)C2=CNC(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])NC(=O)C2=CNC(=O)N2

InChI

InChI=1S/C13H13N3O4/c17-11(10-7-14-13(20)16-10)15-9(12(18)19)6-8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,15,17)(H,18,19)(H2,14,16,20)/p-1/t9-/m0/s1