1-(4-fluorophenyl)-4-[4-(2-phenyl-1-propan-2-yloxy-ethyl)piperazin-1-yl]butan-1-one dihydrochloride

Systemtic Name: 1-(4-fluorophenyl)-4-[4-(2-phenyl-1-propan-2-yloxy-ethyl)piperazin-1-yl]butan-1-one dihydrochloride Openeye Name: 1-(4-fluorophenyl)-4-[4-(1-isopropoxy-2-phenyl-ethyl)piperazin-1-yl]butan-1-one dihydrochloride CAS Name: 1-(4-fluorophenyl)-4-[4-(2-phenyl-1-propan-2-yloxyethyl)-1-piperazinyl]-1-butanone dihydrochloride IUPAC Name: 1-(4-fluorophenyl)-4-[4-(2-phenyl-1-propan-2-yloxyethyl)piperazin-1-yl]butan-1-one dihydrochloride Traditional Name: 1-(4-fluorophenyl)-4-[4-(1-isopropoxy-2-phenyl-ethyl)piperazino]butan-1-one dihydrochloride Formula: C25H35Cl2FN2O2 MolecularWeight: 485.462003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(CC1=CC=CC=C1)N2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F.Cl.Cl

Isomeric SMILES

CC(C)OC(CC1=CC=CC=C1)N2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F.Cl.Cl

InChI

InChI=1S/C25H33FN2O2.2ClH/c1-20(2)30-25(19-21-7-4-3-5-8-21)28-17-15-27(16-18-28)14-6-9-24(29)22-10-12-23(26)13-11-22;;/h3-5,7-8,10-13,20,25H,6,9,14-19H2,1-2H3;2*1H