ethyl (Z)-8-(1,3-benzodioxol-5-yl)-2-ethanoyl-5-ethyl-oct-5-enoate

Systemtic Name: ethyl (Z)-8-(1,3-benzodioxol-5-yl)-2-ethanoyl-5-ethyl-oct-5-enoate Openeye Name: ethyl (Z)-2-acetyl-8-(1,3-benzodioxol-5-yl)-5-ethyl-oct-5-enoate CAS Name: (Z)-2-acetyl-8-(1,3-benzodioxol-5-yl)-5-ethyl-5-octenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-acetyl-8-(1,3-benzodioxol-5-yl)-5-ethyloct-5-enoate Traditional Name: (Z)-2-acetyl-8-(1,3-benzodioxol-5-yl)-5-ethyl-oct-5-enoic acid ethyl ester Formula: C21H28O5 MolecularWeight: 360.44402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28O5/c1-4-16(9-11-18(15(3)22)21(23)24-5-2)7-6-8-17-10-12-19-20(13-17)26-14-25-19/h7,10,12-13,18H,4-6,8-9,11,14H2,1-3H3/b16-7-