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

Systemtic Name: [7-[(4-fluorophenyl)methyl]-9-oxidanyl-8-oxidanylidene-6H-pyrrolo[3,4-g]quinolin-5-yl] 3-azanylazetidine-1-carboxylate Openeye Name: [7-[(4-fluorophenyl)methyl]-9-hydroxy-8-oxo-6H-pyrrolo[3,4-g]quinolin-5-yl] 3-aminoazetidine-1-carboxylate CAS Name: 3-amino-1-azetidinecarboxylic 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] 3-aminoazetidine-1-carboxylate Traditional Name: 3-aminoazetidine-1-carboxylic acid [7-(4-fluorobenzyl)-9-hydroxy-8-keto-6H-pyrrolo[3,4-g]quinolin-5-yl] ester Formula: C22H19FN4O4 MolecularWeight: 422.409063

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C(=O)OC2=C3CN(C(=O)C3=C(C4=C2C=CC=N4)O)CC5=CC=C(C=C5)F)N

Isomeric SMILES

C1C(CN1C(=O)OC2=C3CN(C(=O)C3=C(C4=C2C=CC=N4)O)CC5=CC=C(C=C5)F)N

InChI

InChI=1S/C22H19FN4O4/c23-13-5-3-12(4-6-13)8-26-11-16-17(21(26)29)19(28)18-15(2-1-7-25-18)20(16)31-22(30)27-9-14(24)10-27/h1-7,14,28H,8-11,24H2