2-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethyl-hex-3-enyl]cyclohexan-1-one

Systemtic Name: 2-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethyl-hex-3-enyl]cyclohexan-1-one Openeye Name: 2-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethyl-hex-3-enyl]cyclohexanone CAS Name: 2-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethylhex-3-enyl]-1-cyclohexanone IUPAC Name: 2-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethylhex-3-enyl]cyclohexan-1-one Traditional Name: 2-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethyl-hex-3-enyl]cyclohexanone Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CCCC1=CC2=C(C=C1)OCO2)CCC3CCCCC3=O

Isomeric SMILES

CC/C(=C\CCC1=CC2=C(C=C1)OCO2)/CCC3CCCCC3=O

InChI

InChI=1S/C21H28O3/c1-2-16(10-12-18-8-3-4-9-19(18)22)6-5-7-17-11-13-20-21(14-17)24-15-23-20/h6,11,13-14,18H,2-5,7-10,12,15H2,1H3/b16-6+