[1-[(3,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] pyridine-3-carboxylate

Systemtic Name: [1-[(3,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] pyridine-3-carboxylate Openeye Name: [2-(3,5-dimethylanilino)-1-methyl-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [1-(3,5-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,5-dimethylanilino)-1-oxopropan-2-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-(3,5-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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