4-(2,4-dichlorophenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carbonitrile

Systemtic Name: 4-(2,4-dichlorophenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carbonitrile Openeye Name: 4-(2,4-dichlorophenyl)-1-(p-tolylsulfonyl)piperidine-4-carbonitrile CAS Name: 4-(2,4-dichlorophenyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarbonitrile IUPAC Name: 4-(2,4-dichlorophenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carbonitrile Traditional Name: 4-(2,4-dichlorophenyl)-1-tosyl-isonipecotonitrile Formula: C19H18Cl2N2O2S MolecularWeight: 409.32942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C#N)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C#N)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H18Cl2N2O2S/c1-14-2-5-16(6-3-14)26(24,25)23-10-8-19(13-22,9-11-23)17-7-4-15(20)12-18(17)21/h2-7,12H,8-11H2,1H3