N-methyl-N-[7-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]-9-oxidanyl-8-oxidanylidene-6H-pyrrolo[3,4-g]quinolin-5-yl]methanesulfonamide

Systemtic Name: N-methyl-N-[7-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]-9-oxidanyl-8-oxidanylidene-6H-pyrrolo[3,4-g]quinolin-5-yl]methanesulfonamide Openeye Name: N-[9-hydroxy-7-[(1-oxidopyridin-1-ium-4-yl)methyl]-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-methyl-methanesulfonamide CAS Name: N-[9-hydroxy-7-[(1-oxido-4-pyridin-1-iumyl)methyl]-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-methylmethanesulfonamide IUPAC Name: N-[9-hydroxy-7-[(1-oxidopyridin-1-ium-4-yl)methyl]-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-methylmethanesulfonamide Traditional Name: N-[9-hydroxy-8-keto-7-[(1-oxidopyridin-1-ium-4-yl)methyl]-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-methyl-methanesulfonamide Formula: C19H18N4O5S MolecularWeight: 414.43502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C2CN(C(=O)C2=C(C3=C1C=CC=N3)O)CC4=CC=[N+](C=C4)[O-])S(=O)(=O)C

Isomeric SMILES

CN(C1=C2CN(C(=O)C2=C(C3=C1C=CC=N3)O)CC4=CC=[N+](C=C4)[O-])S(=O)(=O)C

InChI

InChI=1S/C19H18N4O5S/c1-21(29(2,27)28)17-13-4-3-7-20-16(13)18(24)15-14(17)11-22(19(15)25)10-12-5-8-23(26)9-6-12/h3-9,24H,10-11H2,1-2H3