4-[6-(4-methyl-5-phenyl-1,2,3-triazol-2-yl)-1-benzofuran-2-yl]benzoic acid

Systemtic Name: 4-[6-(4-methyl-5-phenyl-1,2,3-triazol-2-yl)-1-benzofuran-2-yl]benzoic acid Openeye Name: 4-[6-(4-methyl-5-phenyl-triazol-2-yl)benzofuran-2-yl]benzoic acid CAS Name: 4-[6-(4-methyl-5-phenyl-2-triazolyl)-2-benzofuranyl]benzoic acid IUPAC Name: 4-[6-(4-methyl-5-phenyltriazol-2-yl)-1-benzofuran-2-yl]benzoic acid Traditional Name: 4-[6-(4-methyl-5-phenyl-triazol-2-yl)benzofuran-2-yl]benzoic acid Formula: C24H17N3O3 MolecularWeight: 395.41008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C2=CC=CC=C2)C3=CC4=C(C=C3)C=C(O4)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

CC1=NN(N=C1C2=CC=CC=C2)C3=CC4=C(C=C3)C=C(O4)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C24H17N3O3/c1-15-23(17-5-3-2-4-6-17)26-27(25-15)20-12-11-19-13-21(30-22(19)14-20)16-7-9-18(10-8-16)24(28)29/h2-14H,1H3,(H,28,29)