methyl 4-[[2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate

Systemtic Name: methyl 4-[[2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate Openeye Name: methyl 4-[[2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl]amino]benzoate CAS Name: 4-[[2-(5-chloro-2-cyanoanilino)-2-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(5-chloro-2-cyanoanilino)-2-oxoethyl]amino]benzoate Traditional Name: 4-[[2-(5-chloro-2-cyano-anilino)-2-keto-ethyl]amino]benzoic acid methyl ester Formula: C17H14ClN3O3 MolecularWeight: 343.76436

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NCC(=O)NC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NCC(=O)NC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C17H14ClN3O3/c1-24-17(23)11-3-6-14(7-4-11)20-10-16(22)21-15-8-13(18)5-2-12(15)9-19/h2-8,20H,10H2,1H3,(H,21,22)