3-(4-butoxyphenyl)-1-[4-(4-fluorophenyl)piperazin-1-yl]-2-phenyl-heptan-3-ol

Systemtic Name: 3-(4-butoxyphenyl)-1-[4-(4-fluorophenyl)piperazin-1-yl]-2-phenyl-heptan-3-ol Openeye Name: 3-(4-butoxyphenyl)-1-[4-(4-fluorophenyl)piperazin-1-yl]-2-phenyl-heptan-3-ol CAS Name: 3-(4-butoxyphenyl)-1-[4-(4-fluorophenyl)-1-piperazinyl]-2-phenyl-3-heptanol IUPAC Name: 3-(4-butoxyphenyl)-1-[4-(4-fluorophenyl)piperazin-1-yl]-2-phenylheptan-3-ol Traditional Name: 3-(4-butoxyphenyl)-1-[4-(4-fluorophenyl)piperazino]-2-phenyl-heptan-3-ol Formula: C33H43FN2O2 MolecularWeight: 518.705123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=C(C=C1)OCCCC)(C(CN2CCN(CC2)C3=CC=C(C=C3)F)C4=CC=CC=C4)O

Isomeric SMILES

CCCCC(C1=CC=C(C=C1)OCCCC)(C(CN2CCN(CC2)C3=CC=C(C=C3)F)C4=CC=CC=C4)O

InChI

InChI=1S/C33H43FN2O2/c1-3-5-20-33(37,28-12-18-31(19-13-28)38-25-6-4-2)32(27-10-8-7-9-11-27)26-35-21-23-36(24-22-35)30-16-14-29(34)15-17-30/h7-19,32,37H,3-6,20-26H2,1-2H3