[(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-yl] 2-acetyloxybenzoate

Systemtic Name: [(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-yl] 2-acetyloxybenzoate Openeye Name: [(E)-3-(1,3-benzodioxol-5-yl)-1-tert-butyl-allyl] 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic 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] 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [(E)-3-(1,3-benzodioxol-5-yl)-1-tert-butyl-allyl] ester Formula: C23H24O6 MolecularWeight: 396.43306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OC(C=CC2=CC3=C(C=C2)OCO3)C(C)(C)C

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OC(/C=C/C2=CC3=C(C=C2)OCO3)C(C)(C)C

InChI

InChI=1S/C23H24O6/c1-15(24)28-18-8-6-5-7-17(18)22(25)29-21(23(2,3)4)12-10-16-9-11-19-20(13-16)27-14-26-19/h5-13,21H,14H2,1-4H3/b12-10+