5-azanyl-2-[(3-cyanophenyl)carbamoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[(3-cyanophenyl)carbamoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(3-cyanophenyl)carbamoylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[(3-cyanoanilino)-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(3-cyanophenyl)carbamoylamino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[(3-cyanophenyl)carbamoylamino]-5-keto-valeric acid Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NC(CCC(=O)N)C(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NC(CCC(=O)N)C(=O)O)C#N

InChI

InChI=1S/C13H14N4O4/c14-7-8-2-1-3-9(6-8)16-13(21)17-10(12(19)20)4-5-11(15)18/h1-3,6,10H,4-5H2,(H2,15,18)(H,19,20)(H2,16,17,21)