[(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] 1,3-benzodioxole-5-carboxylate Openeye Name: [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] ester IUPAC Name: [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [(2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trienyl] ester Formula: C23H30O4 MolecularWeight: 370.4819

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCOC(=O)C1=CC2=C(C=C1)OCO2)C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H30O4/c1-17(2)7-5-8-18(3)9-6-10-19(4)13-14-25-23(24)20-11-12-21-22(15-20)27-16-26-21/h7,9,11-13,15H,5-6,8,10,14,16H2,1-4H3/b18-9-,19-13-