4-[(3,4-dimethoxyphenyl)methyl]-1-imidazol-1-yl-hex-5-en-1-one

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methyl]-1-imidazol-1-yl-hex-5-en-1-one Openeye Name: 4-[(3,4-dimethoxyphenyl)methyl]-1-imidazol-1-yl-hex-5-en-1-one CAS Name: 4-[(3,4-dimethoxyphenyl)methyl]-1-(1-imidazolyl)-5-hexen-1-one IUPAC Name: 4-[(3,4-dimethoxyphenyl)methyl]-1-imidazol-1-ylhex-5-en-1-one Traditional Name: 1-imidazol-1-yl-4-veratryl-hex-5-en-1-one Formula: C18H22N2O3 MolecularWeight: 314.37888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(CCC(=O)N2C=CN=C2)C=C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(CCC(=O)N2C=CN=C2)C=C)OC

InChI

InChI=1S/C18H22N2O3/c1-4-14(6-8-18(21)20-10-9-19-13-20)11-15-5-7-16(22-2)17(12-15)23-3/h4-5,7,9-10,12-14H,1,6,8,11H2,2-3H3