methyl 5-butyl-1-quinolin-5-yl-pyrazole-4-carboxylate

Systemtic Name: methyl 5-butyl-1-quinolin-5-yl-pyrazole-4-carboxylate Openeye Name: methyl 5-butyl-1-(5-quinolyl)pyrazole-4-carboxylate CAS Name: 5-butyl-1-(5-quinolinyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-butyl-1-quinolin-5-ylpyrazole-4-carboxylate Traditional Name: 5-butyl-1-(5-quinolyl)pyrazole-4-carboxylic acid methyl ester Formula: C18H19N3O2 MolecularWeight: 309.36236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=NN1C2=CC=CC3=C2C=CC=N3)C(=O)OC

Isomeric SMILES

CCCCC1=C(C=NN1C2=CC=CC3=C2C=CC=N3)C(=O)OC

InChI

InChI=1S/C18H19N3O2/c1-3-4-9-17-14(18(22)23-2)12-20-21(17)16-10-5-8-15-13(16)7-6-11-19-15/h5-8,10-12H,3-4,9H2,1-2H3