3-[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoranyl-4-oxidanylidene-1H-quinolin-6-yl]propyl 2-bromanylethanoate

Systemtic Name: 3-[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoranyl-4-oxidanylidene-1H-quinolin-6-yl]propyl 2-bromanylethanoate Openeye Name: 3-[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoro-4-oxo-1H-quinolin-6-yl]propyl 2-bromoacetate CAS Name: 2-bromoacetic acid 3-[3-[[(4-chlorophenyl)methylamino]-oxomethyl]-8-fluoro-4-oxo-1H-quinolin-6-yl]propyl ester IUPAC Name: 3-[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoro-4-oxo-1H-quinolin-6-yl]propyl 2-bromoacetate Traditional Name: 2-bromoacetic acid 3-[3-[(4-chlorobenzyl)carbamoyl]-8-fluoro-4-keto-1H-quinolin-6-yl]propyl ester Formula: C22H19BrClFN2O4 MolecularWeight: 509.752663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C=C(C=C3C2=O)CCCOC(=O)CBr)F)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C=C(C=C3C2=O)CCCOC(=O)CBr)F)Cl

InChI

InChI=1S/C22H19BrClFN2O4/c23-10-19(28)31-7-1-2-14-8-16-20(18(25)9-14)26-12-17(21(16)29)22(30)27-11-13-3-5-15(24)6-4-13/h3-6,8-9,12H,1-2,7,10-11H2,(H,26,29)(H,27,30)