[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl 2,3,4-trimethoxybenzoate

Systemtic Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl 2,3,4-trimethoxybenzoate Openeye Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl ester Formula: C26H23ClN2O5 MolecularWeight: 478.92422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23ClN2O5/c1-31-22-14-13-21(24(32-2)25(22)33-3)26(30)34-16-18-15-29(20-7-5-4-6-8-20)28-23(18)17-9-11-19(27)12-10-17/h4-15H,16H2,1-3H3