9-(4,5-diphenyl-1,2,4-triazol-3-yl)nonanoic acid

Systemtic Name: 9-(4,5-diphenyl-1,2,4-triazol-3-yl)nonanoic acid Openeye Name: 9-(4,5-diphenyl-1,2,4-triazol-3-yl)nonanoic acid CAS Name: 9-(4,5-diphenyl-1,2,4-triazol-3-yl)nonanoic acid IUPAC Name: 9-(4,5-diphenyl-1,2,4-triazol-3-yl)nonanoic acid Traditional Name: 9-(4,5-diphenyl-1,2,4-triazol-3-yl)pelargonic acid Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)CCCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)CCCCCCCCC(=O)O

InChI

InChI=1S/C23H27N3O2/c27-22(28)18-12-4-2-1-3-11-17-21-24-25-23(19-13-7-5-8-14-19)26(21)20-15-9-6-10-16-20/h5-10,13-16H,1-4,11-12,17-18H2,(H,27,28)