[2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 5,6-bis(chloranyl)pyridine-3-carboxylate

Systemtic Name: [2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 5,6-bis(chloranyl)pyridine-3-carboxylate Openeye Name: [2-(4-methylanilino)-2-oxo-1-phenyl-ethyl] 5,6-dichloropyridine-3-carboxylate CAS Name: 5,6-dichloro-3-pyridinecarboxylic acid [2-(4-methylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-methylanilino)-2-oxo-1-phenylethyl] 5,6-dichloropyridine-3-carboxylate Traditional Name: 5,6-dichloronicotinic acid [2-keto-1-phenyl-2-(p-toluidino)ethyl] ester Formula: C21H16Cl2N2O3 MolecularWeight: 415.26934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC(=C(N=C3)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC(=C(N=C3)Cl)Cl

InChI

InChI=1S/C21H16Cl2N2O3/c1-13-7-9-16(10-8-13)25-20(26)18(14-5-3-2-4-6-14)28-21(27)15-11-17(22)19(23)24-12-15/h2-12,18H,1H3,(H,25,26)