[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxylate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxylate Openeye Name: [2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxylate CAS Name: 6-(3,5-dimethyl-1-pyrazolyl)-3-pyridinecarboxylic acid [2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxo-1-phenylethyl] 6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxylate Traditional Name: 6-(3,5-dimethylpyrazol-1-yl)nicotinic acid [2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C21H22N4O3 MolecularWeight: 378.42438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N(C)C)C

Isomeric SMILES

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N(C)C)C

InChI

InChI=1S/C21H22N4O3/c1-14-12-15(2)25(23-14)18-11-10-17(13-22-18)21(27)28-19(20(26)24(3)4)16-8-6-5-7-9-16/h5-13,19H,1-4H3