[2-(1H-benzimidazol-2-yl)-5-phenyl-pyrazol-3-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [2-(1H-benzimidazol-2-yl)-5-phenyl-pyrazol-3-yl] 3,4,5-trimethoxybenzoate Openeye Name: [2-(1H-benzimidazol-2-yl)-5-phenyl-pyrazol-3-yl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [2-(1H-benzimidazol-2-yl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(1H-benzimidazol-2-yl)-5-phenylpyrazol-3-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [2-(1H-benzimidazol-2-yl)-5-phenyl-pyrazol-3-yl] ester Formula: C26H22N4O5 MolecularWeight: 470.47668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC(=NN2C3=NC4=CC=CC=C4N3)C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC(=NN2C3=NC4=CC=CC=C4N3)C5=CC=CC=C5

InChI

InChI=1S/C26H22N4O5/c1-32-21-13-17(14-22(33-2)24(21)34-3)25(31)35-23-15-20(16-9-5-4-6-10-16)29-30(23)26-27-18-11-7-8-12-19(18)28-26/h4-15H,1-3H3,(H,27,28)