(E)-4-(1,3-benzodioxol-5-yl)-4-methyl-1-(3-phenoxyphenyl)pent-1-en-3-one

Systemtic Name: (E)-4-(1,3-benzodioxol-5-yl)-4-methyl-1-(3-phenoxyphenyl)pent-1-en-3-one Openeye Name: (E)-4-(1,3-benzodioxol-5-yl)-4-methyl-1-(3-phenoxyphenyl)pent-1-en-3-one CAS Name: (E)-4-(1,3-benzodioxol-5-yl)-4-methyl-1-(3-phenoxyphenyl)-1-penten-3-one IUPAC Name: (E)-4-(1,3-benzodioxol-5-yl)-4-methyl-1-(3-phenoxyphenyl)pent-1-en-3-one Traditional Name: (E)-4-(1,3-benzodioxol-5-yl)-4-methyl-1-(3-phenoxyphenyl)pent-1-en-3-one Formula: C25H22O4 MolecularWeight: 386.43978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC2=C(C=C1)OCO2)C(=O)C=CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)(C1=CC2=C(C=C1)OCO2)C(=O)/C=C/C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H22O4/c1-25(2,19-12-13-22-23(16-19)28-17-27-22)24(26)14-11-18-7-6-10-21(15-18)29-20-8-4-3-5-9-20/h3-16H,17H2,1-2H3/b14-11+