(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-propenoic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)acrylic acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C=CC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)/C=C/C2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C22H22O5/c1-13-9-14(2)22(16(4)23)15(3)18(13)11-25-21(24)8-6-17-5-7-19-20(10-17)27-12-26-19/h5-10H,11-12H2,1-4H3/b8-6+