(E)-4,4-dimethyl-1-(1-methylcyclohex-3-en-1-yl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-one

Systemtic Name: (E)-4,4-dimethyl-1-(1-methylcyclohex-3-en-1-yl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-one Openeye Name: (E)-4,4-dimethyl-1-(1-methylcyclohex-3-en-1-yl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-one CAS Name: (E)-4,4-dimethyl-1-(1-methyl-1-cyclohex-3-enyl)-2-(1,2,4-triazol-1-yl)-1-penten-3-one IUPAC Name: (E)-4,4-dimethyl-1-(1-methylcyclohex-3-en-1-yl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-one Traditional Name: (E)-4,4-dimethyl-1-(1-methylcyclohex-3-en-1-yl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-one Formula: C16H23N3O MolecularWeight: 273.37332

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC=CC1)C=C(C(=O)C(C)(C)C)N2C=NC=N2

Isomeric SMILES

CC1(CCC=CC1)/C=C(\C(=O)C(C)(C)C)/N2C=NC=N2

InChI

InChI=1S/C16H23N3O/c1-15(2,3)14(20)13(19-12-17-11-18-19)10-16(4)8-6-5-7-9-16/h5-6,10-12H,7-9H2,1-4H3/b13-10+