2-cyclohexyl-1-[2-(4-fluoranylphenoxy)ethyl]-4-(3-phenylpropanoyl)piperazine-2-carbonitrile

Systemtic Name: 2-cyclohexyl-1-[2-(4-fluoranylphenoxy)ethyl]-4-(3-phenylpropanoyl)piperazine-2-carbonitrile Openeye Name: 2-cyclohexyl-1-[2-(4-fluorophenoxy)ethyl]-4-(3-phenylpropanoyl)piperazine-2-carbonitrile CAS Name: 2-cyclohexyl-1-[2-(4-fluorophenoxy)ethyl]-4-(1-oxo-3-phenylpropyl)-2-piperazinecarbonitrile IUPAC Name: 2-cyclohexyl-1-[2-(4-fluorophenoxy)ethyl]-4-(3-phenylpropanoyl)piperazine-2-carbonitrile Traditional Name: 2-cyclohexyl-1-[2-(4-fluorophenoxy)ethyl]-4-hydrocinnamoyl-piperazine-2-carbonitrile Formula: C28H34FN3O2 MolecularWeight: 463.586863

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2(CN(CCN2CCOC3=CC=C(C=C3)F)C(=O)CCC4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC(CC1)C2(CN(CCN2CCOC3=CC=C(C=C3)F)C(=O)CCC4=CC=CC=C4)C#N

InChI

InChI=1S/C28H34FN3O2/c29-25-12-14-26(15-13-25)34-20-19-32-18-17-31(27(33)16-11-23-7-3-1-4-8-23)22-28(32,21-30)24-9-5-2-6-10-24/h1,3-4,7-8,12-15,24H,2,5-6,9-11,16-20,22H2