1-(4-chlorophenyl)-4,4,5-trimethyl-3-(1,2,4-triazol-1-ylmethyl)hexan-3-ol

Systemtic Name: 1-(4-chlorophenyl)-4,4,5-trimethyl-3-(1,2,4-triazol-1-ylmethyl)hexan-3-ol Openeye Name: 1-(4-chlorophenyl)-4,4,5-trimethyl-3-(1,2,4-triazol-1-ylmethyl)hexan-3-ol CAS Name: 1-(4-chlorophenyl)-4,4,5-trimethyl-3-(1,2,4-triazol-1-ylmethyl)-3-hexanol IUPAC Name: 1-(4-chlorophenyl)-4,4,5-trimethyl-3-(1,2,4-triazol-1-ylmethyl)hexan-3-ol Traditional Name: 1-(4-chlorophenyl)-4,4,5-trimethyl-3-(1,2,4-triazol-1-ylmethyl)hexan-3-ol Formula: C18H26ClN3O MolecularWeight: 335.87154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C)C(CCC1=CC=C(C=C1)Cl)(CN2C=NC=N2)O

Isomeric SMILES

CC(C)C(C)(C)C(CCC1=CC=C(C=C1)Cl)(CN2C=NC=N2)O

InChI

InChI=1S/C18H26ClN3O/c1-14(2)17(3,4)18(23,11-22-13-20-12-21-22)10-9-15-5-7-16(19)8-6-15/h5-8,12-14,23H,9-11H2,1-4H3