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

Systemtic Name: [1-[(3-methylphenyl)amino]-1-oxidanylidene-butan-2-yl] pyridine-3-carboxylate Openeye Name: 1-(m-tolylcarbamoyl)propyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [1-(3-methylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(3-methylanilino)-1-oxobutan-2-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid 1-(m-tolylcarbamoyl)propyl ester Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3/c1-3-15(22-17(21)13-7-5-9-18-11-13)16(20)19-14-8-4-6-12(2)10-14/h4-11,15H,3H2,1-2H3,(H,19,20)