[1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]propan-2-yl] pyridine-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]propan-2-yl] pyridine-4-carboxylate Openeye Name: [2-(4-isopropylanilino)-1-methyl-2-oxo-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [1-oxo-1-(4-propan-2-ylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-propan-2-ylanilino)propan-2-yl] pyridine-4-carboxylate Traditional Name: isonicotinic acid (2-cumidino-2-keto-1-methyl-ethyl) ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3/c1-12(2)14-4-6-16(7-5-14)20-17(21)13(3)23-18(22)15-8-10-19-11-9-15/h4-13H,1-3H3,(H,20,21)