6-(4-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)hexan-3-ol

Systemtic Name: 6-(4-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)hexan-3-ol Openeye Name: 6-(4-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)hexan-3-ol CAS Name: 6-(4-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)-3-hexanol IUPAC Name: 6-(4-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)hexan-3-ol Traditional Name: 6-(4-chlorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)hexan-3-ol Formula: C16H22ClN3O MolecularWeight: 307.81838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(CCC1=CC=C(C=C1)Cl)N2C=NC=N2)O

Isomeric SMILES

CC(C)(C)C(C(CCC1=CC=C(C=C1)Cl)N2C=NC=N2)O

InChI

InChI=1S/C16H22ClN3O/c1-16(2,3)15(21)14(20-11-18-10-19-20)9-6-12-4-7-13(17)8-5-12/h4-5,7-8,10-11,14-15,21H,6,9H2,1-3H3