ethyl (E)-8-(1,3-benzodioxol-5-yl)-5-ethyl-2-propanoyl-oct-5-enoate

Systemtic Name: ethyl (E)-8-(1,3-benzodioxol-5-yl)-5-ethyl-2-propanoyl-oct-5-enoate Openeye Name: ethyl (E)-8-(1,3-benzodioxol-5-yl)-5-ethyl-2-propanoyl-oct-5-enoate CAS Name: (E)-8-(1,3-benzodioxol-5-yl)-5-ethyl-2-(1-oxopropyl)-5-octenoic acid ethyl ester IUPAC Name: ethyl (E)-8-(1,3-benzodioxol-5-yl)-5-ethyl-2-propanoyloct-5-enoate Traditional Name: (E)-8-(1,3-benzodioxol-5-yl)-5-ethyl-2-propionyl-oct-5-enoic acid ethyl ester Formula: C22H30O5 MolecularWeight: 374.4706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30O5/c1-4-16(10-12-18(19(23)5-2)22(24)25-6-3)8-7-9-17-11-13-20-21(14-17)27-15-26-20/h8,11,13-14,18H,4-7,9-10,12,15H2,1-3H3/b16-8+