ethanol; 4-fluoranyl-N-(4-fluorophenyl)-N-(3-piperazin-1-ylpropyl)aniline; dihydrochloride

Systemtic Name: ethanol; 4-fluoranyl-N-(4-fluorophenyl)-N-(3-piperazin-1-ylpropyl)aniline; dihydrochloride Openeye Name: ethanol; 4-fluoro-N-(4-fluorophenyl)-N-(3-piperazin-1-ylpropyl)aniline; dihydrochloride CAS Name: ethanol; 4-fluoro-N-(4-fluorophenyl)-N-[3-(1-piperazinyl)propyl]aniline; dihydrochloride IUPAC Name: ethanol; 4-fluoro-N-(4-fluorophenyl)-N-(3-piperazin-1-ylpropyl)aniline; dihydrochloride Traditional Name: bis(4-fluorophenyl)-(3-piperazinopropyl)amine; ethanol; dihydrochloride Formula: C21H31Cl2F2N3O MolecularWeight: 450.393146

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Descriptors Computed from Structure

Canonical SMILES:

CCO.C1CN(CCN1)CCCN(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.Cl.Cl

Isomeric SMILES

CCO.C1CN(CCN1)CCCN(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.Cl.Cl

InChI

InChI=1S/C19H23F2N3.C2H6O.2ClH/c20-16-2-6-18(7-3-16)24(19-8-4-17(21)5-9-19)13-1-12-23-14-10-22-11-15-23;1-2-3;;/h2-9,22H,1,10-15H2;3H,2H2,1H3;2*1H