(E)-1-(1,3-benzodioxol-5-yl)-3-(4-butoxy-3-methoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(4-butoxy-3-methoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(4-butoxy-3-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(4-butoxy-3-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(4-butoxy-3-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(4-butoxy-3-methoxy-phenyl)prop-2-en-1-one Formula: C21H22O5 MolecularWeight: 354.39638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)C2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)C2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C21H22O5/c1-3-4-11-24-18-9-6-15(12-20(18)23-2)5-8-17(22)16-7-10-19-21(13-16)26-14-25-19/h5-10,12-13H,3-4,11,14H2,1-2H3/b8-5+