dimethyl 4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C27H29NO6 MolecularWeight: 463.52226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1CCCC2=CC=CC=C2)C)C(=O)OC)C3=CC4=C(C=C3)OCO4)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1CCCC2=CC=CC=C2)C)C(=O)OC)C3=CC4=C(C=C3)OCO4)C(=O)OC

InChI

InChI=1S/C27H29NO6/c1-17-23(26(29)31-3)25(20-12-13-21-22(15-20)34-16-33-21)24(27(30)32-4)18(2)28(17)14-8-11-19-9-6-5-7-10-19/h5-7,9-10,12-13,15,25H,8,11,14,16H2,1-4H3