4-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethyl-hex-3-enyl]-4-methyl-heptane-3,5-dione

Systemtic Name: 4-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethyl-hex-3-enyl]-4-methyl-heptane-3,5-dione Openeye Name: 4-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethyl-hex-3-enyl]-4-methyl-heptane-3,5-dione CAS Name: 4-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethylhex-3-enyl]-4-methylheptane-3,5-dione IUPAC Name: 4-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethylhex-3-enyl]-4-methylheptane-3,5-dione Traditional Name: 4-[(E)-6-(1,3-benzodioxol-5-yl)-3-ethyl-hex-3-enyl]-4-methyl-heptane-3,5-dione Formula: C23H32O4 MolecularWeight: 372.49778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32O4/c1-5-17(13-14-23(4,21(24)6-2)22(25)7-3)9-8-10-18-11-12-19-20(15-18)27-16-26-19/h9,11-12,15H,5-8,10,13-14,16H2,1-4H3/b17-9+