(1,3-diphenylpyrazol-4-yl)methyl 2,4-dimethoxybenzoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 2,4-dimethoxybenzoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 2,4-dimethoxybenzoate CAS Name: 2,4-dimethoxybenzoic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 2,4-dimethoxybenzoate Traditional Name: 2,4-dimethoxybenzoic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C25H22N2O4 MolecularWeight: 414.45318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H22N2O4/c1-29-21-13-14-22(23(15-21)30-2)25(28)31-17-19-16-27(20-11-7-4-8-12-20)26-24(19)18-9-5-3-6-10-18/h3-16H,17H2,1-2H3