2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)octan-3-ol

Systemtic Name: 2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)octan-3-ol Openeye Name: 2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)octan-3-ol CAS Name: 2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)-3-octanol IUPAC Name: 2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)octan-3-ol Traditional Name: 2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)octan-3-ol Formula: C13H25N3O MolecularWeight: 239.3571

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CN1C=NC=N1)(C(C)(C)C)O

Isomeric SMILES

CCCCCC(CN1C=NC=N1)(C(C)(C)C)O

InChI

InChI=1S/C13H25N3O/c1-5-6-7-8-13(17,12(2,3)4)9-16-11-14-10-15-16/h10-11,17H,5-9H2,1-4H3