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

Systemtic Name: 6-(4-methyl-5-phenyl-1,2,3-triazol-2-yl)-1-benzofuran-2-carboxylic acid Openeye Name: 6-(4-methyl-5-phenyl-triazol-2-yl)benzofuran-2-carboxylic acid CAS Name: 6-(4-methyl-5-phenyl-2-triazolyl)-2-benzofurancarboxylic acid IUPAC Name: 6-(4-methyl-5-phenyltriazol-2-yl)-1-benzofuran-2-carboxylic acid Traditional Name: 6-(4-methyl-5-phenyl-triazol-2-yl)coumarilic acid Formula: C18H13N3O3 MolecularWeight: 319.31412

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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)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H13N3O3/c1-11-17(12-5-3-2-4-6-12)20-21(19-11)14-8-7-13-9-16(18(22)23)24-15(13)10-14/h2-10H,1H3,(H,22,23)