ethyl 4-(6-ethoxycarbonyl-2,3,4-trimethoxy-phenyl)-1,3-benzodioxole-5-carboxylate

Systemtic Name: ethyl 4-(6-ethoxycarbonyl-2,3,4-trimethoxy-phenyl)-1,3-benzodioxole-5-carboxylate Openeye Name: ethyl 4-(6-ethoxycarbonyl-2,3,4-trimethoxy-phenyl)-1,3-benzodioxole-5-carboxylate CAS Name: 4-(6-ethoxycarbonyl-2,3,4-trimethoxyphenyl)-1,3-benzodioxole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(6-ethoxycarbonyl-2,3,4-trimethoxyphenyl)-1,3-benzodioxole-5-carboxylate Traditional Name: 4-(6-carbethoxy-2,3,4-trimethoxy-phenyl)-piperonylic acid ethyl ester Formula: C22H24O9 MolecularWeight: 432.42056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C1)OCO2)C3=C(C(=C(C=C3C(=O)OCC)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C1)OCO2)C3=C(C(=C(C=C3C(=O)OCC)OC)OC)OC

InChI

InChI=1S/C22H24O9/c1-6-28-21(23)12-8-9-14-18(31-11-30-14)16(12)17-13(22(24)29-7-2)10-15(25-3)19(26-4)20(17)27-5/h8-10H,6-7,11H2,1-5H3