methyl 2-[3-(3-pyridin-4-ylphenyl)pyrazol-1-yl]butanoate

Systemtic Name: methyl 2-[3-(3-pyridin-4-ylphenyl)pyrazol-1-yl]butanoate Openeye Name: methyl 2-[3-[3-(4-pyridyl)phenyl]pyrazol-1-yl]butanoate CAS Name: 2-[3-(3-pyridin-4-ylphenyl)-1-pyrazolyl]butanoic acid methyl ester IUPAC Name: methyl 2-[3-(3-pyridin-4-ylphenyl)pyrazol-1-yl]butanoate Traditional Name: 2-[3-[3-(4-pyridyl)phenyl]pyrazol-1-yl]butyric acid methyl ester Formula: C19H19N3O2 MolecularWeight: 321.37306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC)N1C=CC(=N1)C2=CC=CC(=C2)C3=CC=NC=C3

Isomeric SMILES

CCC(C(=O)OC)N1C=CC(=N1)C2=CC=CC(=C2)C3=CC=NC=C3

InChI

InChI=1S/C19H19N3O2/c1-3-18(19(23)24-2)22-12-9-17(21-22)16-6-4-5-15(13-16)14-7-10-20-11-8-14/h4-13,18H,3H2,1-2H3