7,10-dimethyl-8-oxidanyl-phenazin-5-ium-2-one; methyl sulfate

Systemtic Name: 7,10-dimethyl-8-oxidanyl-phenazin-5-ium-2-one; methyl sulfate Openeye Name: 8-hydroxy-7,10-dimethyl-phenazin-5-ium-2-one; methyl sulfate CAS Name: 8-hydroxy-7,10-dimethyl-2-phenazin-5-iumone; methyl sulfate IUPAC Name: 8-hydroxy-7,10-dimethylphenazin-5-ium-2-one; methyl sulfate Traditional Name: 8-hydroxy-7,10-dimethyl-phenazin-5-ium-2-one; methyl sulfate Formula: C15H16N2O6S MolecularWeight: 352.36234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1O)N(C3=CC(=O)C=CC3=[NH+]2)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1O)N(C3=CC(=O)C=CC3=[NH+]2)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C14H12N2O2.CH4O4S/c1-8-5-11-13(7-14(8)18)16(2)12-6-9(17)3-4-10(12)15-11;1-5-6(2,3)4/h3-7,18H,1-2H3;1H3,(H,2,3,4)