[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] 2-methyl-6-phenyl-pyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] 2-methyl-6-phenyl-pyridine-3-carboxylate Openeye Name: [2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl] 2-methyl-6-phenyl-pyridine-3-carboxylate CAS Name: 2-methyl-6-phenyl-3-pyridinecarboxylic acid [2-oxo-2-(2-oxolanylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(oxolan-2-ylmethylamino)ethyl] 2-methyl-6-phenylpyridine-3-carboxylate Traditional Name: 2-methyl-6-phenyl-nicotinic acid [2-keto-2-(tetrahydrofurfurylamino)ethyl] ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)OCC(=O)NCC3CCCO3

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)OCC(=O)NCC3CCCO3

InChI

InChI=1S/C20H22N2O4/c1-14-17(9-10-18(22-14)15-6-3-2-4-7-15)20(24)26-13-19(23)21-12-16-8-5-11-25-16/h2-4,6-7,9-10,16H,5,8,11-13H2,1H3,(H,21,23)