1,3-benzodioxol-5-ylmethyl (Z)-octadec-9-enoate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl (Z)-octadec-9-enoate Openeye Name: 1,3-benzodioxol-5-ylmethyl (Z)-octadec-9-enoate CAS Name: (Z)-9-octadecenoic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl (Z)-octadec-9-enoate Traditional Name: (Z)-octadec-9-enoic acid piperonyl ester Formula: C26H40O4 MolecularWeight: 416.5934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)OCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C26H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(27)28-21-23-18-19-24-25(20-23)30-22-29-24/h9-10,18-20H,2-8,11-17,21-22H2,1H3/b10-9-