(2S)-5-azanyl-2-[(3-cyanophenyl)carbonylamino]-5-oxidanylidene-pentanoate

Systemtic Name: (2S)-5-azanyl-2-[(3-cyanophenyl)carbonylamino]-5-oxidanylidene-pentanoate Openeye Name: (2S)-5-amino-2-[(3-cyanobenzoyl)amino]-5-oxo-pentanoate CAS Name: (2S)-5-amino-2-[[(3-cyanophenyl)-oxomethyl]amino]-5-oxopentanoate IUPAC Name: (2S)-5-amino-2-[(3-cyanobenzoyl)amino]-5-oxopentanoate Traditional Name: (2S)-5-amino-2-[(3-cyanobenzoyl)amino]-5-keto-valerate Formula: C13H12N3O4- MolecularWeight: 274.25208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O4/c14-7-8-2-1-3-9(6-8)12(18)16-10(13(19)20)4-5-11(15)17/h1-3,6,10H,4-5H2,(H2,15,17)(H,16,18)(H,19,20)/p-1/t10-/m0/s1