1-(4-pentylphenyl)sulfonyl-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-(4-pentylphenyl)sulfonyl-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-(4-pentylphenyl)sulfonyl-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-(4-pentylphenyl)sulfonyl-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-(4-pentylphenyl)sulfonyl-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-(4-amylphenyl)sulfonyl-4-phenyl-isonipecotonitrile Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O2S/c1-2-3-5-8-20-11-13-22(14-12-20)28(26,27)25-17-15-23(19-24,16-18-25)21-9-6-4-7-10-21/h4,6-7,9-14H,2-3,5,8,15-18H2,1H3