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

Systemtic Name: 2-methyl-7-oxidanylidene-4-(trifluoromethyl)-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid Openeye Name: 2-methyl-7-oxo-4-(trifluoromethyl)-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid CAS Name: 2-methyl-7-oxo-4-(trifluoromethyl)-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid IUPAC Name: 2-methyl-7-oxo-4-(trifluoromethyl)-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid Traditional Name: 7-keto-2-methyl-4-(trifluoromethyl)-3,6-dihydro-1H-pyrrolo[3,4-f]quinoline-8-sulfonic acid Formula: C13H11F3N2O4S MolecularWeight: 348.29765

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C1)C3=C(C=C2C(F)(F)F)NC(=O)C(=C3)S(=O)(=O)O

Isomeric SMILES

CN1CC2=C(C1)C3=C(C=C2C(F)(F)F)NC(=O)C(=C3)S(=O)(=O)O

InChI

InChI=1S/C13H11F3N2O4S/c1-18-4-7-6-2-11(23(20,21)22)12(19)17-10(6)3-9(8(7)5-18)13(14,15)16/h2-3H,4-5H2,1H3,(H,17,19)(H,20,21,22)