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

Systemtic Name: (E)-1-cyclohexyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-one Openeye Name: (E)-1-cyclohexyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-one CAS Name: (E)-1-cyclohexyl-2-(1,2,4-triazol-1-yl)-1-penten-3-one IUPAC Name: (E)-1-cyclohexyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-one Traditional Name: (E)-1-cyclohexyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-one Formula: C13H19N3O MolecularWeight: 233.30946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=CC1CCCCC1)N2C=NC=N2

Isomeric SMILES

CCC(=O)/C(=C\C1CCCCC1)/N2C=NC=N2

InChI

InChI=1S/C13H19N3O/c1-2-13(17)12(16-10-14-9-15-16)8-11-6-4-3-5-7-11/h8-11H,2-7H2,1H3/b12-8+