8-(3-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol

Systemtic Name: 8-(3-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol Openeye Name: 8-(3-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol CAS Name: 8-(3-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)-3-octanol IUPAC Name: 8-(3-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol Traditional Name: 8-(3-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol Formula: C18H26ClN3O MolecularWeight: 335.87154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(CCCCC1=CC(=CC=C1)Cl)N2C=NC=N2)O

Isomeric SMILES

CC(C)(C)C(C(CCCCC1=CC(=CC=C1)Cl)N2C=NC=N2)O

InChI

InChI=1S/C18H26ClN3O/c1-18(2,3)17(23)16(22-13-20-12-21-22)10-5-4-7-14-8-6-9-15(19)11-14/h6,8-9,11-13,16-17,23H,4-5,7,10H2,1-3H3