4-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-4-fluoranyl-1-phenyl-butan-1-one hydrochloride

Systemtic Name: 4-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-4-fluoranyl-1-phenyl-butan-1-one hydrochloride Openeye Name: 4-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-4-fluoro-1-phenyl-butan-1-one hydrochloride CAS Name: 4-[4-[(4-bromophenyl)methyl]-1-piperazinyl]-4-fluoro-1-phenyl-1-butanone hydrochloride IUPAC Name: 4-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-4-fluoro-1-phenylbutan-1-one hydrochloride Traditional Name: 4-[4-(4-bromobenzyl)piperazino]-4-fluoro-1-phenyl-butan-1-one hydrochloride Formula: C21H25BrClFN2O MolecularWeight: 455.791403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Br)C(CCC(=O)C3=CC=CC=C3)F.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Br)C(CCC(=O)C3=CC=CC=C3)F.Cl

InChI

InChI=1S/C21H24BrFN2O.ClH/c22-19-8-6-17(7-9-19)16-24-12-14-25(15-13-24)21(23)11-10-20(26)18-4-2-1-3-5-18;/h1-9,21H,10-16H2;1H