[2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 6-chloranylpyridine-3-carboxylate

Systemtic Name: [2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 6-chloranylpyridine-3-carboxylate Openeye Name: [2-(4-methylanilino)-2-oxo-1-phenyl-ethyl] 6-chloropyridine-3-carboxylate CAS Name: 6-chloro-3-pyridinecarboxylic acid [2-(4-methylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-methylanilino)-2-oxo-1-phenylethyl] 6-chloropyridine-3-carboxylate Traditional Name: 6-chloronicotinic acid [2-keto-1-phenyl-2-(p-toluidino)ethyl] ester Formula: C21H17ClN2O3 MolecularWeight: 380.82428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN2O3/c1-14-7-10-17(11-8-14)24-20(25)19(15-5-3-2-4-6-15)27-21(26)16-9-12-18(22)23-13-16/h2-13,19H,1H3,(H,24,25)