2,2,6-trimethyl-7-(2-methylphenyl)-4-(1,2,4-triazol-1-yl)heptan-3-ol

Systemtic Name: 2,2,6-trimethyl-7-(2-methylphenyl)-4-(1,2,4-triazol-1-yl)heptan-3-ol Openeye Name: 2,2,6-trimethyl-7-(o-tolyl)-4-(1,2,4-triazol-1-yl)heptan-3-ol CAS Name: 2,2,6-trimethyl-7-(2-methylphenyl)-4-(1,2,4-triazol-1-yl)-3-heptanol IUPAC Name: 2,2,6-trimethyl-7-(2-methylphenyl)-4-(1,2,4-triazol-1-yl)heptan-3-ol Traditional Name: 2,2,6-trimethyl-7-(o-tolyl)-4-(1,2,4-triazol-1-yl)heptan-3-ol Formula: C19H29N3O MolecularWeight: 315.45306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(C)CC(C(C(C)(C)C)O)N2C=NC=N2

Isomeric SMILES

CC1=CC=CC=C1CC(C)CC(C(C(C)(C)C)O)N2C=NC=N2

InChI

InChI=1S/C19H29N3O/c1-14(10-16-9-7-6-8-15(16)2)11-17(18(23)19(3,4)5)22-13-20-12-21-22/h6-9,12-14,17-18,23H,10-11H2,1-5H3