[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 6-methylpyridine-3-carboxylate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 6-methylpyridine-3-carboxylate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] 6-methylpyridine-3-carboxylate CAS Name: 6-methyl-3-pyridinecarboxylic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] 6-methylpyridine-3-carboxylate Traditional Name: 6-methylnicotinic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)OCC(=O)NCC2=CC=CC=C2C

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)OCC(=O)NCC2=CC=CC=C2C

InChI

InChI=1S/C17H18N2O3/c1-12-5-3-4-6-14(12)9-19-16(20)11-22-17(21)15-8-7-13(2)18-10-15/h3-8,10H,9,11H2,1-2H3,(H,19,20)