2-(3-bromanyl-4-methoxy-phenyl)-5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]pentanenitrile

Systemtic Name: 2-(3-bromanyl-4-methoxy-phenyl)-5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]pentanenitrile Openeye Name: 2-(3-bromo-4-methoxy-phenyl)-5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]pentanenitrile CAS Name: 2-(3-bromo-4-methoxyphenyl)-5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]pentanenitrile IUPAC Name: 2-(3-bromo-4-methoxyphenyl)-5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]pentanenitrile Traditional Name: 2-(3-bromo-4-methoxy-phenyl)-5-[4-(4-chlorophenyl)-4-hydroxy-piperidino]valeronitrile Formula: C23H26BrClN2O2 MolecularWeight: 477.82174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)C#N)Br

InChI

InChI=1S/C23H26BrClN2O2/c1-29-22-9-4-17(15-21(22)24)18(16-26)3-2-12-27-13-10-23(28,11-14-27)19-5-7-20(25)8-6-19/h4-9,15,18,28H,2-3,10-14H2,1H3