4-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 4-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 4-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 4-[[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 4-[4-(5-chloro-2-fluorobenzoyl)piperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 4-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]carbostyril Formula: C21H17ClFN3O3 MolecularWeight: 413.829383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=O)NC3=CC=CC=C32)C(=O)C4=C(C=CC(=C4)Cl)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=O)NC3=CC=CC=C32)C(=O)C4=C(C=CC(=C4)Cl)F

InChI

InChI=1S/C21H17ClFN3O3/c22-13-5-6-17(23)16(11-13)21(29)26-9-7-25(8-10-26)20(28)15-12-19(27)24-18-4-2-1-3-14(15)18/h1-6,11-12H,7-10H2,(H,24,27)