(E)-1-cyclopentyl-3-(3,4-dimethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one

Systemtic Name: (E)-1-cyclopentyl-3-(3,4-dimethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one Openeye Name: (E)-1-cyclopentyl-3-(3,4-dimethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one CAS Name: (E)-1-cyclopentyl-3-(3,4-dimethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)-2-propen-1-one IUPAC Name: (E)-1-cyclopentyl-3-(3,4-dimethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one Traditional Name: (E)-1-cyclopentyl-3-(3,4-dimethoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one Formula: C19H18N3O3 MolecularWeight: 336.36452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(CN2C=NC=N2)C(=O)[C]3[CH][CH][CH][CH]3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\CN2C=NC=N2)/C(=O)[C]3[CH][CH][CH][CH]3)OC

InChI

InChI=1S/C19H18N3O3/c1-24-17-8-7-14(10-18(17)25-2)9-16(11-22-13-20-12-21-22)19(23)15-5-3-4-6-15/h3-10,12-13H,11H2,1-2H3/b16-9+