(3,3-dimethyl-2-oxidanylidene-butyl) 2-[(4-ethoxyphenyl)amino]pyridine-3-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[(4-ethoxyphenyl)amino]pyridine-3-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-(4-ethoxyanilino)pyridine-3-carboxylate CAS Name: 2-(4-ethoxyanilino)-3-pyridinecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-(4-ethoxyanilino)pyridine-3-carboxylate Traditional Name: 2-(p-phenetidino)nicotinic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C20H24N2O4/c1-5-25-15-10-8-14(9-11-15)22-18-16(7-6-12-21-18)19(24)26-13-17(23)20(2,3)4/h6-12H,5,13H2,1-4H3,(H,21,22)