4-[3,5-bis(methoxycarbonyl)-1-[(4-methoxyphenyl)methyl]-4H-pyridin-4-yl]-2-ethoxy-6-nitro-phenolate

Systemtic Name: 4-[3,5-bis(methoxycarbonyl)-1-[(4-methoxyphenyl)methyl]-4H-pyridin-4-yl]-2-ethoxy-6-nitro-phenolate Openeye Name: 4-[3,5-bis(methoxycarbonyl)-1-[(4-methoxyphenyl)methyl]-4H-pyridin-4-yl]-2-ethoxy-6-nitro-phenolate CAS Name: 4-[3,5-bis(methoxycarbonyl)-1-[(4-methoxyphenyl)methyl]-4H-pyridin-4-yl]-2-ethoxy-6-nitrophenolate IUPAC Name: 4-[3,5-bis(methoxycarbonyl)-1-[(4-methoxyphenyl)methyl]-4H-pyridin-4-yl]-2-ethoxy-6-nitrophenolate Traditional Name: 4-(3,5-dicarbomethoxy-1-p-anisyl-4H-pyridin-4-yl)-2-ethoxy-6-nitro-phenolate Formula: C25H25N2O9- MolecularWeight: 497.474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C2C(=CN(C=C2C(=O)OC)CC3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C2C(=CN(C=C2C(=O)OC)CC3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C25H26N2O9/c1-5-36-21-11-16(10-20(23(21)28)27(31)32)22-18(24(29)34-3)13-26(14-19(22)25(30)35-4)12-15-6-8-17(33-2)9-7-15/h6-11,13-14,22,28H,5,12H2,1-4H3/p-1