2-[3-[(4-fluorophenyl)methyl]-7-methyl-9-oxidanyl-8-oxidanylidene-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-methylsulfonyl-ethanamide

Systemtic Name: 2-[3-[(4-fluorophenyl)methyl]-7-methyl-9-oxidanyl-8-oxidanylidene-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-methylsulfonyl-ethanamide Openeye Name: 2-[3-[(4-fluorophenyl)methyl]-9-hydroxy-7-methyl-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-methylsulfonyl-acetamide CAS Name: 2-[3-[(4-fluorophenyl)methyl]-9-hydroxy-7-methyl-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-methylsulfonylacetamide IUPAC Name: 2-[3-[(4-fluorophenyl)methyl]-9-hydroxy-7-methyl-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-methylsulfonylacetamide Traditional Name: 2-[3-(4-fluorobenzyl)-9-hydroxy-8-keto-7-methyl-6H-pyrrolo[3,4-g]quinolin-5-yl]-N-mesyl-acetamide Formula: C22H20FN3O5S MolecularWeight: 457.474703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20FN3O5S/c1-26-11-17-15(9-18(27)25-32(2,30)31)16-8-13(7-12-3-5-14(23)6-4-12)10-24-20(16)21(28)19(17)22(26)29/h3-6,8,10,28H,7,9,11H2,1-2H3,(H,25,27)