9-[1-(4-methylphenyl)-1,2,3-triazol-4-yl]nonanoic acid

Systemtic Name: 9-[1-(4-methylphenyl)-1,2,3-triazol-4-yl]nonanoic acid Openeye Name: 9-[1-(p-tolyl)triazol-4-yl]nonanoic acid CAS Name: 9-[1-(4-methylphenyl)-4-triazolyl]nonanoic acid IUPAC Name: 9-[1-(4-methylphenyl)triazol-4-yl]nonanoic acid Traditional Name: 9-[1-(p-tolyl)triazol-4-yl]pelargonic acid Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(N=N2)CCCCCCCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(N=N2)CCCCCCCCC(=O)O

InChI

InChI=1S/C18H25N3O2/c1-15-10-12-17(13-11-15)21-14-16(19-20-21)8-6-4-2-3-5-7-9-18(22)23/h10-14H,2-9H2,1H3,(H,22,23)