dimethyl 4-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(1,3-benzodioxol-5-yl)-1-benzyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(1,3-benzodioxol-5-yl)-1-benzyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-1-benzyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C23H21NO6 MolecularWeight: 407.41594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C=C(C1C2=CC3=C(C=C2)OCO3)C(=O)OC)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CN(C=C(C1C2=CC3=C(C=C2)OCO3)C(=O)OC)CC4=CC=CC=C4

InChI

InChI=1S/C23H21NO6/c1-27-22(25)17-12-24(11-15-6-4-3-5-7-15)13-18(23(26)28-2)21(17)16-8-9-19-20(10-16)30-14-29-19/h3-10,12-13,21H,11,14H2,1-2H3