(E)-1-cyclopentyl-3-(4-methylphenyl)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-cyclopentyl-3-(4-methylphenyl)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one Openeye Name: (E)-1-cyclopentyl-3-(p-tolyl)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one CAS Name: (E)-1-cyclopentyl-3-(4-methylphenyl)-2-(1,2,4-triazol-1-yl)-2-propen-1-one IUPAC Name: (E)-1-cyclopentyl-3-(4-methylphenyl)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one Traditional Name: (E)-1-cyclopentyl-3-(p-tolyl)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one Formula: C17H14N3O MolecularWeight: 276.31256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C(=O)[C]2[CH][CH][CH][CH]2)N3C=NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C(=O)[C]2[CH][CH][CH][CH]2)/N3C=NC=N3

InChI

InChI=1S/C17H14N3O/c1-13-6-8-14(9-7-13)10-16(20-12-18-11-19-20)17(21)15-4-2-3-5-15/h2-12H,1H3/b16-10+