10-(dimethylamino)-3,7-bis(oxidanyl)chromeno[3,2-a]phenoxazin-13-ium-6,14-dione chloride

Systemtic Name: 10-(dimethylamino)-3,7-bis(oxidanyl)chromeno[3,2-a]phenoxazin-13-ium-6,14-dione chloride Openeye Name: 10-(dimethylamino)-3,7-dihydroxy-chromeno[3,2-a]phenoxazin-13-ium-6,14-dione chloride CAS Name: 10-(dimethylamino)-3,7-dihydroxy[1]benzopyrano[3,2-a]phenoxazin-13-ium-6,14-dione chloride IUPAC Name: 10-(dimethylamino)-3,7-dihydroxychromeno[3,2-a]phenoxazin-13-ium-6,14-dione chloride Traditional Name: 10-(dimethylamino)-3,7-dihydroxy-chromeno[3,2-a]phenoxazin-13-ium-6,14-quinone chloride Formula: C21H15ClN2O6 MolecularWeight: 426.8066

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)[NH+]=C3C4=C(C(=O)C(=C3O2)O)OC5=C(C4=O)C=CC(=C5)O.[Cl-]

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)[NH+]=C3C4=C(C(=O)C(=C3O2)O)OC5=C(C4=O)C=CC(=C5)O.[Cl-]

InChI

InChI=1S/C21H14N2O6.ClH/c1-23(2)9-3-6-12-14(7-9)29-21-16(22-12)15-17(25)11-5-4-10(24)8-13(11)28-20(15)18(26)19(21)27;/h3-8,24,27H,1-2H3;1H