[7-[(4-fluorophenyl)methyl]-9-oxidanyl-8-oxidanylidene-6H-pyrrolo[3,4-g]quinolin-5-yl] 4-methylpiperazine-1-sulfonate

Systemtic Name: [7-[(4-fluorophenyl)methyl]-9-oxidanyl-8-oxidanylidene-6H-pyrrolo[3,4-g]quinolin-5-yl] 4-methylpiperazine-1-sulfonate Openeye Name: [7-[(4-fluorophenyl)methyl]-9-hydroxy-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl] 4-methylpiperazine-1-sulfonate CAS Name: 4-methyl-1-piperazinesulfonic acid [7-[(4-fluorophenyl)methyl]-9-hydroxy-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl] ester IUPAC Name: [7-[(4-fluorophenyl)methyl]-9-hydroxy-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl] 4-methylpiperazine-1-sulfonate Traditional Name: 4-methylpiperazine-1-sulfonic acid [7-(4-fluorobenzyl)-9-hydroxy-8-keto-6H-pyrrolo[3,4-g]quinolin-5-yl] ester Formula: C23H23FN4O5S MolecularWeight: 486.515923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)OC2=C3CN(C(=O)C3=C(C4=C2C=CC=N4)O)CC5=CC=C(C=C5)F

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)OC2=C3CN(C(=O)C3=C(C4=C2C=CC=N4)O)CC5=CC=C(C=C5)F

InChI

InChI=1S/C23H23FN4O5S/c1-26-9-11-28(12-10-26)34(31,32)33-22-17-3-2-8-25-20(17)21(29)19-18(22)14-27(23(19)30)13-15-4-6-16(24)7-5-15/h2-8,29H,9-14H2,1H3