7-(4,5-diphenyl-1,2,3-triazol-2-yl)-2-methyl-heptanoic acid

Systemtic Name: 7-(4,5-diphenyl-1,2,3-triazol-2-yl)-2-methyl-heptanoic acid Openeye Name: 7-(4,5-diphenyltriazol-2-yl)-2-methyl-heptanoic acid CAS Name: 7-(4,5-diphenyl-2-triazolyl)-2-methylheptanoic acid IUPAC Name: 7-(4,5-diphenyltriazol-2-yl)-2-methylheptanoic acid Traditional Name: 7-(4,5-diphenyltriazol-2-yl)-2-methyl-enanthic acid Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCN1N=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(CCCCCN1N=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H25N3O2/c1-17(22(26)27)11-5-4-10-16-25-23-20(18-12-6-2-7-13-18)21(24-25)19-14-8-3-9-15-19/h2-3,6-9,12-15,17H,4-5,10-11,16H2,1H3,(H,26,27)