dimethyl 1-(1,3-benzodioxol-5-ylmethyl)-4-(3,4-dimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-(1,3-benzodioxol-5-ylmethyl)-4-(3,4-dimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-(1,3-benzodioxol-5-ylmethyl)-4-(3,4-dimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3,4-dimethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(1,3-benzodioxol-5-ylmethyl)-4-(3,4-dimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-1-piperonyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C25H25NO8 MolecularWeight: 467.4679

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC4=C(C=C3)OCO4)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC4=C(C=C3)OCO4)C(=O)OC)OC

InChI

InChI=1S/C25H25NO8/c1-29-19-8-6-16(10-21(19)30-2)23-17(24(27)31-3)12-26(13-18(23)25(28)32-4)11-15-5-7-20-22(9-15)34-14-33-20/h5-10,12-13,23H,11,14H2,1-4H3