(2S)-4-azanyl-2-[(3-cyanophenyl)carbonylamino]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-azanyl-2-[(3-cyanophenyl)carbonylamino]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-amino-2-[(3-cyanobenzoyl)amino]-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(3-cyanophenyl)-oxomethyl]amino]-4-oxobutanoate IUPAC Name: (2S)-4-amino-2-[(3-cyanobenzoyl)amino]-4-oxobutanoate Traditional Name: (2S)-4-amino-2-[(3-cyanobenzoyl)amino]-4-keto-butyrate Formula: C12H10N3O4- MolecularWeight: 260.2255

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NC(CC(=O)N)C(=O)[O-])C#N

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O4/c13-6-7-2-1-3-8(4-7)11(17)15-9(12(18)19)5-10(14)16/h1-4,9H,5H2,(H2,14,16)(H,15,17)(H,18,19)/p-1/t9-/m0/s1