dimethyl 6,7-dimethoxy-1-(1-oxidanidylpyridin-1-ium-4-yl)naphthalene-2,3-dicarboxylate

Systemtic Name: dimethyl 6,7-dimethoxy-1-(1-oxidanidylpyridin-1-ium-4-yl)naphthalene-2,3-dicarboxylate Openeye Name: dimethyl 6,7-dimethoxy-1-(1-oxidopyridin-1-ium-4-yl)naphthalene-2,3-dicarboxylate CAS Name: 6,7-dimethoxy-1-(1-oxido-4-pyridin-1-iumyl)naphthalene-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 6,7-dimethoxy-1-(1-oxidopyridin-1-ium-4-yl)naphthalene-2,3-dicarboxylate Traditional Name: 6,7-dimethoxy-1-(1-oxidopyridin-1-ium-4-yl)naphthalene-2,3-dicarboxylic acid dimethyl ester Formula: C21H19NO7 MolecularWeight: 397.37806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC=[N+](C=C3)[O-])C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC=[N+](C=C3)[O-])C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H19NO7/c1-26-16-10-13-9-15(20(23)28-3)19(21(24)29-4)18(14(13)11-17(16)27-2)12-5-7-22(25)8-6-12/h5-11H,1-4H3