4-[(2-cyanophenyl)carbamoylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(2-cyanophenyl)carbamoylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[(2-cyanophenyl)carbamoylamino]-4-oxo-butanoate CAS Name: 4-[[(2-cyanoanilino)-oxomethyl]amino]-4-oxobutanoate IUPAC Name: 4-[(2-cyanophenyl)carbamoylamino]-4-oxobutanoate Traditional Name: 4-[(2-cyanophenyl)carbamoylamino]-4-keto-butyrate Formula: C12H10N3O4- MolecularWeight: 260.2255

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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