8-(4-fluoranylphenoxy)-2-phenyl-6-piperazin-1-yl-2-propan-2-yl-decanenitrile

Systemtic Name: 8-(4-fluoranylphenoxy)-2-phenyl-6-piperazin-1-yl-2-propan-2-yl-decanenitrile Openeye Name: 8-(4-fluorophenoxy)-2-isopropyl-2-phenyl-6-piperazin-1-yl-decanenitrile CAS Name: 8-(4-fluorophenoxy)-2-phenyl-6-(1-piperazinyl)-2-propan-2-yldecanenitrile IUPAC Name: 8-(4-fluorophenoxy)-2-phenyl-6-piperazin-1-yl-2-propan-2-yldecanenitrile Traditional Name: 8-(4-fluorophenoxy)-2-isopropyl-2-phenyl-6-piperazino-capronitrile Formula: C29H40FN3O MolecularWeight: 465.645803

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CCCC(C#N)(C1=CC=CC=C1)C(C)C)N2CCNCC2)OC3=CC=C(C=C3)F

Isomeric SMILES

CCC(CC(CCCC(C#N)(C1=CC=CC=C1)C(C)C)N2CCNCC2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C29H40FN3O/c1-4-27(34-28-14-12-25(30)13-15-28)21-26(33-19-17-32-18-20-33)11-8-16-29(22-31,23(2)3)24-9-6-5-7-10-24/h5-7,9-10,12-15,23,26-27,32H,4,8,11,16-21H2,1-3H3