(1E)-1-(1,3-benzodioxol-5-yl)-7-methyl-octa-1,6-dien-3-one

Systemtic Name: (1E)-1-(1,3-benzodioxol-5-yl)-7-methyl-octa-1,6-dien-3-one Openeye Name: (1E)-1-(1,3-benzodioxol-5-yl)-7-methyl-octa-1,6-dien-3-one CAS Name: (1E)-1-(1,3-benzodioxol-5-yl)-7-methyl-3-octa-1,6-dienone IUPAC Name: (1E)-1-(1,3-benzodioxol-5-yl)-7-methylocta-1,6-dien-3-one Traditional Name: (1E)-1-(1,3-benzodioxol-5-yl)-7-methyl-octa-1,6-dien-3-one Formula: C16H18O3 MolecularWeight: 258.31232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=O)C=CC1=CC2=C(C=C1)OCO2)C

Isomeric SMILES

CC(=CCCC(=O)/C=C/C1=CC2=C(C=C1)OCO2)C

InChI

InChI=1S/C16H18O3/c1-12(2)4-3-5-14(17)8-6-13-7-9-15-16(10-13)19-11-18-15/h4,6-10H,3,5,11H2,1-2H3/b8-6+