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

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-butan-2-yl] pyridine-4-carboxylate Openeye Name: 1-(o-tolylcarbamoyl)propyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [1-(2-methylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxobutan-2-yl] pyridine-4-carboxylate Traditional Name: isonicotinic acid 1-(o-tolylcarbamoyl)propyl ester Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C)OC(=O)C2=CC=NC=C2

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C)OC(=O)C2=CC=NC=C2

InChI

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