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

Systemtic Name: 9-ethyl-6-nitro-4,7,8,10-tetrahydro-1H-pyrido[3,4-f]quinoxaline-2,3-dione; methanesulfonic acid Openeye Name: 9-ethyl-6-nitro-4,7,8,10-tetrahydro-1H-pyrido[3,4-f]quinoxaline-2,3-dione; methanesulfonic acid CAS Name: 9-ethyl-6-nitro-4,7,8,10-tetrahydro-1H-pyrido[3,4-f]quinoxaline-2,3-dione; methanesulfonic acid IUPAC Name: 9-ethyl-6-nitro-4,7,8,10-tetrahydro-1H-pyrido[3,4-f]quinoxaline-2,3-dione; methanesulfonic acid Traditional Name: 9-ethyl-6-nitro-4,7,8,10-tetrahydro-1H-pyrido[3,4-f]quinoxaline-2,3-quinone; mesylic acid Formula: C14H18N4O7S MolecularWeight: 386.38032

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C=C3C(=C2C1)NC(=O)C(=O)N3)[N+](=O)[O-].CS(=O)(=O)O

Isomeric SMILES

CCN1CCC2=C(C=C3C(=C2C1)NC(=O)C(=O)N3)[N+](=O)[O-].CS(=O)(=O)O

InChI

InChI=1S/C13H14N4O4.CH4O3S/c1-2-16-4-3-7-8(6-16)11-9(5-10(7)17(20)21)14-12(18)13(19)15-11;1-5(2,3)4/h5H,2-4,6H2,1H3,(H,14,18)(H,15,19);1H3,(H,2,3,4)