ethyl (E)-3-[2-(1,3-benzodioxol-5-yl)-3,4,5-trimethoxy-phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[2-(1,3-benzodioxol-5-yl)-3,4,5-trimethoxy-phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[2-(1,3-benzodioxol-5-yl)-3,4,5-trimethoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[2-(1,3-benzodioxol-5-yl)-3,4,5-trimethoxyphenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-(1,3-benzodioxol-5-yl)-3,4,5-trimethoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[2-(1,3-benzodioxol-5-yl)-3,4,5-trimethoxy-phenyl]acrylic acid ethyl ester Formula: C21H22O7 MolecularWeight: 386.39518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC(=C(C(=C1C2=CC3=C(C=C2)OCO3)OC)OC)OC

Isomeric SMILES

CCOC(=O)/C=C/C1=CC(=C(C(=C1C2=CC3=C(C=C2)OCO3)OC)OC)OC

InChI

InChI=1S/C21H22O7/c1-5-26-18(22)9-7-14-11-17(23-2)20(24-3)21(25-4)19(14)13-6-8-15-16(10-13)28-12-27-15/h6-11H,5,12H2,1-4H3/b9-7+