2-methyl-4-nitro-7-oxidanylidene-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid

Systemtic Name: 2-methyl-4-nitro-7-oxidanylidene-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid Openeye Name: 2-methyl-4-nitro-7-oxo-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid CAS Name: 2-methyl-4-nitro-7-oxo-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid IUPAC Name: 2-methyl-4-nitro-7-oxo-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid Traditional Name: 7-keto-2-methyl-4-nitro-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid Formula: C12H11N3O6S MolecularWeight: 325.29724

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C3C=C(C(=O)NC3=CC(=C2C1)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

CN1CC2=C3C=C(C(=O)NC3=CC(=C2C1)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C12H11N3O6S/c1-14-4-7-6-2-11(22(19,20)21)12(16)13-9(6)3-10(15(17)18)8(7)5-14/h2-3H,4-5H2,1H3,(H,13,16)(H,19,20,21)