methanesulfonic acid; 8-methyl-6-nitro-4,7,9,10-tetrahydro-1H-pyrido[4,3-f]quinoxaline-2,3-dione

Systemtic Name: methanesulfonic acid; 8-methyl-6-nitro-4,7,9,10-tetrahydro-1H-pyrido[4,3-f]quinoxaline-2,3-dione Openeye Name: methanesulfonic acid; 8-methyl-6-nitro-4,7,9,10-tetrahydro-1H-pyrido[4,3-f]quinoxaline-2,3-dione CAS Name: methanesulfonic acid; 8-methyl-6-nitro-4,7,9,10-tetrahydro-1H-pyrido[4,3-f]quinoxaline-2,3-dione IUPAC Name: methanesulfonic acid; 8-methyl-6-nitro-4,7,9,10-tetrahydro-1H-pyrido[4,3-f]quinoxaline-2,3-dione Traditional Name: mesylic acid; 8-methyl-6-nitro-4,7,9,10-tetrahydro-1H-pyrido[4,3-f]quinoxaline-2,3-quinone Formula: C13H16N4O7S MolecularWeight: 372.35374

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C3C(=CC(=C2C1)[N+](=O)[O-])NC(=O)C(=O)N3.CS(=O)(=O)O

Isomeric SMILES

CN1CCC2=C3C(=CC(=C2C1)[N+](=O)[O-])NC(=O)C(=O)N3.CS(=O)(=O)O

InChI

InChI=1S/C12H12N4O4.CH4O3S/c1-15-3-2-6-7(5-15)9(16(19)20)4-8-10(6)14-12(18)11(17)13-8;1-5(2,3)4/h4H,2-3,5H2,1H3,(H,13,17)(H,14,18);1H3,(H,2,3,4)