7-chloranyl-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol

Systemtic Name: 7-chloranyl-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol Openeye Name: 7-chloro-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol CAS Name: 7-chloro-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)-3-heptanol IUPAC Name: 7-chloro-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol Traditional Name: 7-chloro-2,2-dimethyl-3-(1,2,4-triazol-1-ylmethyl)heptan-3-ol Formula: C12H22ClN3O MolecularWeight: 259.77558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CCCCCl)(CN1C=NC=N1)O

Isomeric SMILES

CC(C)(C)C(CCCCCl)(CN1C=NC=N1)O

InChI

InChI=1S/C12H22ClN3O/c1-11(2,3)12(17,6-4-5-7-13)8-16-10-14-9-15-16/h9-10,17H,4-8H2,1-3H3