[1-[(4-chlorophenyl)amino]-1-oxidanylidene-butan-2-yl] pyridine-3-carboxylate

Systemtic Name: [1-[(4-chlorophenyl)amino]-1-oxidanylidene-butan-2-yl] pyridine-3-carboxylate Openeye Name: 1-[(4-chlorophenyl)carbamoyl]propyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [1-(4-chloroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-chloroanilino)-1-oxobutan-2-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid 1-[(4-chlorophenyl)carbamoyl]propyl ester Formula: C16H15ClN2O3 MolecularWeight: 318.7549

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)Cl)OC(=O)C2=CN=CC=C2

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)Cl)OC(=O)C2=CN=CC=C2

InChI

InChI=1S/C16H15ClN2O3/c1-2-14(22-16(21)11-4-3-9-18-10-11)15(20)19-13-7-5-12(17)6-8-13/h3-10,14H,2H2,1H3,(H,19,20)