methanesulfonate; 7-methyl-1,4-dihydropyrido[3,2-f]quinoxalin-7-ium-2,3-dione

Systemtic Name: methanesulfonate; 7-methyl-1,4-dihydropyrido[3,2-f]quinoxalin-7-ium-2,3-dione Openeye Name: methanesulfonate; 7-methyl-1,4-dihydropyrido[3,2-f]quinoxalin-7-ium-2,3-dione CAS Name: methanesulfonate; 7-methyl-1,4-dihydropyrido[3,2-f]quinoxalin-7-ium-2,3-dione IUPAC Name: methanesulfonate; 7-methyl-1,4-dihydropyrido[3,2-f]quinoxalin-7-ium-2,3-dione Traditional Name: 7-methyl-1,4-dihydropyrido[3,2-f]quinoxalin-7-ium-2,3-quinone mesylate Formula: C13H13N3O5S MolecularWeight: 323.32442

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC2=C1C=CC3=C2NC(=O)C(=O)N3.CS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CC=CC2=C1C=CC3=C2NC(=O)C(=O)N3.CS(=O)(=O)[O-]

InChI

InChI=1S/C12H9N3O2.CH4O3S/c1-15-6-2-3-7-9(15)5-4-8-10(7)14-12(17)11(16)13-8;1-5(2,3)4/h2-6H,1H3,(H,13,16);1H3,(H,2,3,4)