dimethyl 1-[(3,4-dimethoxyphenyl)methyl]-4-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-[(3,4-dimethoxyphenyl)methyl]-4-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-[(3,4-dimethoxyphenyl)methyl]-4-(3-ethoxy-4-hydroxy-5-nitro-phenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[(3,4-dimethoxyphenyl)methyl]-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-ethoxy-4-hydroxy-5-nitro-phenyl)-1-veratryl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C26H28N2O10 MolecularWeight: 528.50792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C2C(=CN(C=C2C(=O)OC)CC3=CC(=C(C=C3)OC)OC)C(=O)OC

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C2C(=CN(C=C2C(=O)OC)CC3=CC(=C(C=C3)OC)OC)C(=O)OC

InChI

InChI=1S/C26H28N2O10/c1-6-38-22-11-16(10-19(24(22)29)28(32)33)23-17(25(30)36-4)13-27(14-18(23)26(31)37-5)12-15-7-8-20(34-2)21(9-15)35-3/h7-11,13-14,23,29H,6,12H2,1-5H3