7-(diethylamino)-3,4-bis(oxidanyl)-10H-phenoxazin-10-ium-1-carboxamide chloride

Systemtic Name: 7-(diethylamino)-3,4-bis(oxidanyl)-10H-phenoxazin-10-ium-1-carboxamide chloride Openeye Name: 7-(diethylamino)-3,4-dihydroxy-10H-phenoxazin-10-ium-1-carboxamide chloride CAS Name: 7-(diethylamino)-3,4-dihydroxy-10H-phenoxazin-10-ium-1-carboxamide chloride IUPAC Name: 7-(diethylamino)-3,4-dihydroxy-10H-phenoxazin-10-ium-1-carboxamide chloride Traditional Name: 7-(diethylamino)-3,4-dihydroxy-10H-phenoxazin-10-ium-1-carboxamide chloride Formula: C17H20ClN3O4 MolecularWeight: 365.8114

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)[NH2+]C3=C(O2)C(=C(C=C3C(=O)N)O)O.[Cl-]

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)[NH2+]C3=C(O2)C(=C(C=C3C(=O)N)O)O.[Cl-]

InChI

InChI=1S/C17H19N3O4.ClH/c1-3-20(4-2)9-5-6-11-13(7-9)24-16-14(19-11)10(17(18)23)8-12(21)15(16)22;/h5-8,19,21-22H,3-4H2,1-2H3,(H2,18,23);1H