5,5-dimethyl-4-oxidanyl-1-(1,2,4-triazol-1-yl)hexan-3-one

Systemtic Name: 5,5-dimethyl-4-oxidanyl-1-(1,2,4-triazol-1-yl)hexan-3-one Openeye Name: 4-hydroxy-5,5-dimethyl-1-(1,2,4-triazol-1-yl)hexan-3-one CAS Name: 4-hydroxy-5,5-dimethyl-1-(1,2,4-triazol-1-yl)-3-hexanone IUPAC Name: 4-hydroxy-5,5-dimethyl-1-(1,2,4-triazol-1-yl)hexan-3-one Traditional Name: 4-hydroxy-5,5-dimethyl-1-(1,2,4-triazol-1-yl)hexan-3-one Formula: C10H17N3O2 MolecularWeight: 211.26088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)CCN1C=NC=N1)O

Isomeric SMILES

CC(C)(C)C(C(=O)CCN1C=NC=N1)O

InChI

InChI=1S/C10H17N3O2/c1-10(2,3)9(15)8(14)4-5-13-7-11-6-12-13/h6-7,9,15H,4-5H2,1-3H3