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

Systemtic Name: [2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl] 3-cyanobenzoate Openeye Name: [2-(2,4-dichloroanilino)-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-(2,4-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dichloroanilino)-2-oxoethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(2,4-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(=C1)C(=O)OCC(=O)NC2=C(C=C(C=C2)Cl)Cl)C#N

Isomeric SMILES

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

InChI

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