(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[(4-chlorophenyl)carbonylamino]benzoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[(4-chlorophenyl)carbonylamino]benzoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-[(4-chlorobenzoyl)amino]benzoate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]benzoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-[(4-chlorobenzoyl)amino]benzoate Traditional Name: 2-[(4-chlorobenzoyl)amino]benzoic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C20H16ClN3O4 MolecularWeight: 397.81174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H16ClN3O4/c1-12(23)16(10-22)18(25)11-28-20(27)15-4-2-3-5-17(15)24-19(26)13-6-8-14(21)9-7-13/h2-9,16,23H,11H2,1H3,(H,24,26)