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

Systemtic Name: 4-[4-(1-butan-2-yloxy-2-phenyl-ethyl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-[4-(2-phenyl-1-sec-butoxy-ethyl)piperazin-1-yl]butan-1-one CAS Name: 4-[4-(1-butan-2-yloxy-2-phenylethyl)-1-piperazinyl]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-[4-(1-butan-2-yloxy-2-phenylethyl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-[4-(2-phenyl-1-sec-butoxy-ethyl)piperazino]butan-1-one Formula: C26H35FN2O2 MolecularWeight: 426.566703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35FN2O2/c1-3-21(2)31-26(20-22-8-5-4-6-9-22)29-18-16-28(17-19-29)15-7-10-25(30)23-11-13-24(27)14-12-23/h4-6,8-9,11-14,21,26H,3,7,10,15-20H2,1-2H3