methyl 1,6-dimethoxy-12-oxidanidyl-5-oxidanylidene-7,8,9,10-tetrahydrobenzo[b]phenazin-5-ium-8-carboxylate

Systemtic Name: methyl 1,6-dimethoxy-12-oxidanidyl-5-oxidanylidene-7,8,9,10-tetrahydrobenzo[b]phenazin-5-ium-8-carboxylate Openeye Name: methyl 1,6-dimethoxy-12-oxido-5-oxo-7,8,9,10-tetrahydrobenzo[b]phenazin-5-ium-8-carboxylate CAS Name: 1,6-dimethoxy-12-oxido-5-oxo-7,8,9,10-tetrahydrobenzo[b]phenazin-5-ium-8-carboxylic acid methyl ester IUPAC Name: methyl 1,6-dimethoxy-12-oxido-5-oxo-7,8,9,10-tetrahydrobenzo[b]phenazin-5-ium-8-carboxylate Traditional Name: 5-keto-1,6-dimethoxy-12-oxido-7,8,9,10-tetrahydrobenzo[b]phenazin-5-ium-8-carboxylic acid methyl ester Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N(C3=C([N+]2=O)C(=C4CC(CCC4=C3)C(=O)OC)OC)[O-]

Isomeric SMILES

COC1=CC=CC2=C1N(C3=C([N+]2=O)C(=C4CC(CCC4=C3)C(=O)OC)OC)[O-]

InChI

InChI=1S/C20H20N2O6/c1-26-16-6-4-5-14-17(16)22(25)15-10-11-7-8-12(20(23)28-3)9-13(11)19(27-2)18(15)21(14)24/h4-6,10,12H,7-9H2,1-3H3