ethyl 5-(1-methylpyrrol-3-yl)-1-pyridin-3-yl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(1-methylpyrrol-3-yl)-1-pyridin-3-yl-pyrazole-3-carboxylate Openeye Name: ethyl 5-(1-methylpyrrol-3-yl)-1-(3-pyridyl)pyrazole-3-carboxylate CAS Name: 5-(1-methyl-3-pyrrolyl)-1-(3-pyridinyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1-methylpyrrol-3-yl)-1-pyridin-3-ylpyrazole-3-carboxylate Traditional Name: 5-(1-methylpyrrol-3-yl)-1-(3-pyridyl)pyrazole-3-carboxylic acid ethyl ester Formula: C16H16N4O2 MolecularWeight: 296.32384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CN(C=C2)C)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CN(C=C2)C)C3=CN=CC=C3

InChI

InChI=1S/C16H16N4O2/c1-3-22-16(21)14-9-15(12-6-8-19(2)11-12)20(18-14)13-5-4-7-17-10-13/h4-11H,3H2,1-2H3