5-[4-(4-chlorophenyl)-1-oxidanidyl-4-oxidanyl-piperidin-1-ium-1-yl]-2,2-diphenyl-pentanenitrile

Systemtic Name: 5-[4-(4-chlorophenyl)-1-oxidanidyl-4-oxidanyl-piperidin-1-ium-1-yl]-2,2-diphenyl-pentanenitrile Openeye Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-oxido-piperidin-1-ium-1-yl]-2,2-diphenyl-pentanenitrile CAS Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-oxido-1-piperidin-1-iumyl]-2,2-diphenylpentanenitrile IUPAC Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-oxidopiperidin-1-ium-1-yl]-2,2-diphenylpentanenitrile Traditional Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-oxido-piperidin-1-ium-1-yl]-2,2-diphenyl-valeronitrile Formula: C28H29ClN2O2 MolecularWeight: 460.99506

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCC1(C2=CC=C(C=C2)Cl)O)(CCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4)[O-]

Isomeric SMILES

C1C[N+](CCC1(C2=CC=C(C=C2)Cl)O)(CCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C28H29ClN2O2/c29-26-14-12-25(13-15-26)28(32)17-20-31(33,21-18-28)19-7-16-27(22-30,23-8-3-1-4-9-23)24-10-5-2-6-11-24/h1-6,8-15,32H,7,16-21H2