3-[(4-fluorophenyl)methyl]-7-methyl-N-methylsulfonyl-9-oxidanyl-8-oxidanylidene-6H-pyrrolo[3,4-g]quinoline-5-carboxamide

Systemtic Name: 3-[(4-fluorophenyl)methyl]-7-methyl-N-methylsulfonyl-9-oxidanyl-8-oxidanylidene-6H-pyrrolo[3,4-g]quinoline-5-carboxamide Openeye Name: 3-[(4-fluorophenyl)methyl]-9-hydroxy-7-methyl-N-methylsulfonyl-8-oxo-6H-pyrrolo[3,4-g]quinoline-5-carboxamide CAS Name: 3-[(4-fluorophenyl)methyl]-9-hydroxy-7-methyl-N-methylsulfonyl-8-oxo-6H-pyrrolo[3,4-g]quinoline-5-carboxamide IUPAC Name: 3-[(4-fluorophenyl)methyl]-9-hydroxy-7-methyl-N-methylsulfonyl-8-oxo-6H-pyrrolo[3,4-g]quinoline-5-carboxamide Traditional Name: 3-(4-fluorobenzyl)-9-hydroxy-8-keto-N-mesyl-7-methyl-6H-pyrrolo[3,4-g]quinoline-5-carboxamide Formula: C21H18FN3O5S MolecularWeight: 443.448123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C3=CC(=CN=C3C(=C2C1=O)O)CC4=CC=C(C=C4)F)C(=O)NS(=O)(=O)C

Isomeric SMILES

CN1CC2=C(C3=CC(=CN=C3C(=C2C1=O)O)CC4=CC=C(C=C4)F)C(=O)NS(=O)(=O)C

InChI

InChI=1S/C21H18FN3O5S/c1-25-10-15-16(20(27)24-31(2,29)30)14-8-12(7-11-3-5-13(22)6-4-11)9-23-18(14)19(26)17(15)21(25)28/h3-6,8-9,26H,7,10H2,1-2H3,(H,24,27)