1-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-3-(2,5-dimethoxyphenyl)propan-1-one

Systemtic Name: 1-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-3-(2,5-dimethoxyphenyl)propan-1-one Openeye Name: 1-[4-(5-chloro-2-fluoro-benzoyl)piperazin-1-yl]-3-(2,5-dimethoxyphenyl)propan-1-one CAS Name: 1-[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-(2,5-dimethoxyphenyl)-1-propanone IUPAC Name: 1-[4-(5-chloro-2-fluorobenzoyl)piperazin-1-yl]-3-(2,5-dimethoxyphenyl)propan-1-one Traditional Name: 1-[4-(5-chloro-2-fluoro-benzoyl)piperazino]-3-(2,5-dimethoxyphenyl)propan-1-one Formula: C22H24ClFN2O4 MolecularWeight: 434.888363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCC(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCC(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C22H24ClFN2O4/c1-29-17-5-7-20(30-2)15(13-17)3-8-21(27)25-9-11-26(12-10-25)22(28)18-14-16(23)4-6-19(18)24/h4-7,13-14H,3,8-12H2,1-2H3