1-[4-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]butan-1-one

Systemtic Name: 1-[4-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]butan-1-one Openeye Name: 1-[4-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-3-fluoro-phenyl]butan-1-one CAS Name: 1-[4-[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-3-fluorophenyl]-1-butanone IUPAC Name: 1-[4-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-3-fluorophenyl]butan-1-one Traditional Name: 1-[4-[4-(2,4-dichlorobenzoyl)piperazino]-3-fluoro-phenyl]butan-1-one Formula: C21H21Cl2FN2O2 MolecularWeight: 423.308043

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)Cl)F

Isomeric SMILES

CCCC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)Cl)F

InChI

InChI=1S/C21H21Cl2FN2O2/c1-2-3-20(27)14-4-7-19(18(24)12-14)25-8-10-26(11-9-25)21(28)16-6-5-15(22)13-17(16)23/h4-7,12-13H,2-3,8-11H2,1H3