4-[[4-(4-diphenylphosphorylphenyl)-1,2,3-triazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[4-(4-diphenylphosphorylphenyl)-1,2,3-triazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[4-(4-diphenylphosphorylphenyl)triazol-1-yl]methyl]benzoic acid CAS Name: 4-[[4-(4-diphenylphosphorylphenyl)-1-triazolyl]methyl]benzoic acid IUPAC Name: 4-[[4-(4-diphenylphosphorylphenyl)triazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[4-(4-diphenylphosphorylphenyl)triazol-1-yl]methyl]benzoic acid Formula: C28H22N3O3P MolecularWeight: 479.466341

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CN(N=N4)CC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CN(N=N4)CC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C28H22N3O3P/c32-28(33)23-13-11-21(12-14-23)19-31-20-27(29-30-31)22-15-17-26(18-16-22)35(34,24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-18,20H,19H2,(H,32,33)