[(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-yl] tetradecanoate

Systemtic Name: [(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-yl] tetradecanoate Openeye Name: [(E)-3-(1,3-benzodioxol-5-yl)-1-tert-butyl-allyl] tetradecanoate CAS Name: tetradecanoic acid [(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethylpent-1-en-3-yl] ester IUPAC Name: [(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethylpent-1-en-3-yl] tetradecanoate Traditional Name: myristic acid [(E)-3-(1,3-benzodioxol-5-yl)-1-tert-butyl-allyl] ester Formula: C28H44O4 MolecularWeight: 444.64656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OC(C=CC1=CC2=C(C=C1)OCO2)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OC(/C=C/C1=CC2=C(C=C1)OCO2)C(C)(C)C

InChI

InChI=1S/C28H44O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-27(29)32-26(28(2,3)4)20-18-23-17-19-24-25(21-23)31-22-30-24/h17-21,26H,5-16,22H2,1-4H3/b20-18+