diethyl [7-[(4-fluorophenyl)methyl]-9-oxidanyl-6,8-bis(oxidanylidene)pyrrolo[3,4-g]quinolin-5-yl] phosphate

Systemtic Name: diethyl [7-[(4-fluorophenyl)methyl]-9-oxidanyl-6,8-bis(oxidanylidene)pyrrolo[3,4-g]quinolin-5-yl] phosphate Openeye Name: diethyl [7-[(4-fluorophenyl)methyl]-9-hydroxy-6,8-dioxo-pyrrolo[3,4-g]quinolin-5-yl] phosphate CAS Name: phosphoric acid diethyl [7-[(4-fluorophenyl)methyl]-9-hydroxy-6,8-dioxo-5-pyrrolo[3,4-g]quinolinyl] ester IUPAC Name: diethyl [7-[(4-fluorophenyl)methyl]-9-hydroxy-6,8-dioxopyrrolo[3,4-g]quinolin-5-yl] phosphate Traditional Name: phosphoric acid diethyl [7-(4-fluorobenzyl)-9-hydroxy-6,8-diketo-pyrrolo[3,4-g]quinolin-5-yl] ester Formula: C22H20FN2O7P MolecularWeight: 474.375564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC1=C2C(=C(C3=C1C=CC=N3)O)C(=O)N(C2=O)CC4=CC=C(C=C4)F

Isomeric SMILES

CCOP(=O)(OCC)OC1=C2C(=C(C3=C1C=CC=N3)O)C(=O)N(C2=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN2O7P/c1-3-30-33(29,31-4-2)32-20-15-6-5-11-24-18(15)19(26)16-17(20)22(28)25(21(16)27)12-13-7-9-14(23)10-8-13/h5-11,26H,3-4,12H2,1-2H3