[2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl] 4-cyanobenzoate

Systemtic Name: [2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-(3,4-dichloroanilino)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(3,4-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dichloroanilino)-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(3,4-dichloroanilino)-2-keto-ethyl] ester Formula: C16H10Cl2N2O3 MolecularWeight: 349.1682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H10Cl2N2O3/c17-13-6-5-12(7-14(13)18)20-15(21)9-23-16(22)11-3-1-10(8-19)2-4-11/h1-7H,9H2,(H,20,21)