sodium 2-[[7-(dimethylamino)-3,4-bis(oxidanylidene)-10H-phenoxazin-1-yl]amino]benzenesulfonate

Systemtic Name: sodium 2-[[7-(dimethylamino)-3,4-bis(oxidanylidene)-10H-phenoxazin-1-yl]amino]benzenesulfonate Openeye Name: sodium 2-[[7-(dimethylamino)-3,4-dioxo-10H-phenoxazin-1-yl]amino]benzenesulfonate CAS Name: sodium 2-[[7-(dimethylamino)-3,4-dioxo-10H-phenoxazin-1-yl]amino]benzenesulfonate IUPAC Name: sodium 2-[[7-(dimethylamino)-3,4-dioxo-10H-phenoxazin-1-yl]amino]benzenesulfonate Traditional Name: sodium 2-[[7-(dimethylamino)-3,4-diketo-10H-phenoxazin-1-yl]amino]besylate Formula: C20H16N3NaO6S MolecularWeight: 449.41231

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)NC3=C(O2)C(=O)C(=O)C=C3NC4=CC=CC=C4S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)NC3=C(O2)C(=O)C(=O)C=C3NC4=CC=CC=C4S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C20H17N3O6S.Na/c1-23(2)11-7-8-12-16(9-11)29-20-18(22-12)14(10-15(24)19(20)25)21-13-5-3-4-6-17(13)30(26,27)28;/h3-10,21-22H,1-2H3,(H,26,27,28);/q;+1/p-1