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

Systemtic Name: 4-[1-[(3,4-dimethoxyphenyl)methyl]-3,5-bis(methoxycarbonyl)-4H-pyridin-4-yl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[1-[(3,4-dimethoxyphenyl)methyl]-3,5-bis(methoxycarbonyl)-4H-pyridin-4-yl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[1-[(3,4-dimethoxyphenyl)methyl]-3,5-bis(methoxycarbonyl)-4H-pyridin-4-yl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[1-[(3,4-dimethoxyphenyl)methyl]-3,5-bis(methoxycarbonyl)-4H-pyridin-4-yl]-2-methoxy-6-nitrophenolate Traditional Name: 4-(3,5-dicarbomethoxy-1-veratryl-4H-pyridin-4-yl)-2-methoxy-6-nitro-phenolate Formula: C25H25N2O10- MolecularWeight: 513.4734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C=C(C(C(=C2)C(=O)OC)C3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-])C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C=C(C(C(=C2)C(=O)OC)C3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-])C(=O)OC)OC

InChI

InChI=1S/C25H26N2O10/c1-33-19-7-6-14(8-20(19)34-2)11-26-12-16(24(29)36-4)22(17(13-26)25(30)37-5)15-9-18(27(31)32)23(28)21(10-15)35-3/h6-10,12-13,22,28H,11H2,1-5H3/p-1