(2E,4Z,8E)-9-(1,3-benzodioxol-5-yl)-1-cyclohexyl-nona-2,4,8-trien-1-one

Systemtic Name: (2E,4Z,8E)-9-(1,3-benzodioxol-5-yl)-1-cyclohexyl-nona-2,4,8-trien-1-one Openeye Name: (2E,4Z,8E)-9-(1,3-benzodioxol-5-yl)-1-cyclohexyl-nona-2,4,8-trien-1-one CAS Name: (2E,4Z,8E)-9-(1,3-benzodioxol-5-yl)-1-cyclohexyl-1-nona-2,4,8-trienone IUPAC Name: (2E,4Z,8E)-9-(1,3-benzodioxol-5-yl)-1-cyclohexylnona-2,4,8-trien-1-one Traditional Name: (2E,4Z,8E)-9-(1,3-benzodioxol-5-yl)-1-cyclohexyl-nona-2,4,8-trien-1-one Formula: C22H26O3 MolecularWeight: 338.44004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)C=CC=CCCC=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCC(CC1)C(=O)/C=C/C=C\CC/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C22H26O3/c23-20(19-11-7-5-8-12-19)13-9-4-2-1-3-6-10-18-14-15-21-22(16-18)25-17-24-21/h2,4,6,9-10,13-16,19H,1,3,5,7-8,11-12,17H2/b4-2-,10-6+,13-9+