prop-2-ynyl 2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylate

Systemtic Name: prop-2-ynyl 2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylate Openeye Name: prop-2-ynyl 2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)pyridine-3-carboxylate CAS Name: 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-3-pyridinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylate Traditional Name: 2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)nicotinic acid propargyl ester Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=C(C=CC=N2)C(=O)OCC#C)C

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=C(C=CC=N2)C(=O)OCC#C)C

InChI

InChI=1S/C16H17N3O3/c1-5-9-22-14(20)11-7-6-8-17-12(11)13-18-15(21)16(4,19-13)10(2)3/h1,6-8,10H,9H2,2-4H3,(H,18,19,21)