methyl 2-(1-methyl-3-phenylmethoxy-pyrazol-4-yl)-6-phenyl-benzoate

Systemtic Name: methyl 2-(1-methyl-3-phenylmethoxy-pyrazol-4-yl)-6-phenyl-benzoate Openeye Name: methyl 2-(3-benzyloxy-1-methyl-pyrazol-4-yl)-6-phenyl-benzoate CAS Name: 2-(1-methyl-3-phenylmethoxy-4-pyrazolyl)-6-phenylbenzoic acid methyl ester IUPAC Name: methyl 2-(1-methyl-3-phenylmethoxypyrazol-4-yl)-6-phenylbenzoate Traditional Name: 2-(3-benzoxy-1-methyl-pyrazol-4-yl)-6-phenyl-benzoic acid methyl ester Formula: C25H22N2O3 MolecularWeight: 398.45378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)OCC2=CC=CC=C2)C3=CC=CC(=C3C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CN1C=C(C(=N1)OCC2=CC=CC=C2)C3=CC=CC(=C3C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3/c1-27-16-22(24(26-27)30-17-18-10-5-3-6-11-18)21-15-9-14-20(23(21)25(28)29-2)19-12-7-4-8-13-19/h3-16H,17H2,1-2H3