4-[4-[3-(4-fluoranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-1-(4-hydroxyphenyl)cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-[3-(4-fluoranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-1-(4-hydroxyphenyl)cyclohexane-1-carbonitrile Openeye Name: 4-[4-[3-(4-fluorophenoxy)-2-hydroxy-propyl]piperazin-1-yl]-1-(4-hydroxyphenyl)cyclohexanecarbonitrile CAS Name: 4-[4-[3-(4-fluorophenoxy)-2-hydroxypropyl]-1-piperazinyl]-1-(4-hydroxyphenyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-[3-(4-fluorophenoxy)-2-hydroxypropyl]piperazin-1-yl]-1-(4-hydroxyphenyl)cyclohexane-1-carbonitrile Traditional Name: 4-[4-[3-(4-fluorophenoxy)-2-hydroxy-propyl]piperazino]-1-(4-hydroxyphenyl)cyclohexanecarbonitrile Formula: C26H32FN3O3 MolecularWeight: 453.548983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2CCN(CC2)CC(COC3=CC=C(C=C3)F)O)(C#N)C4=CC=C(C=C4)O

Isomeric SMILES

C1CC(CCC1N2CCN(CC2)CC(COC3=CC=C(C=C3)F)O)(C#N)C4=CC=C(C=C4)O

InChI

InChI=1S/C26H32FN3O3/c27-21-3-7-25(8-4-21)33-18-24(32)17-29-13-15-30(16-14-29)22-9-11-26(19-28,12-10-22)20-1-5-23(31)6-2-20/h1-8,22,24,31-32H,9-18H2