4-cyano-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]benzenesulfonamide Openeye Name: 4-cyano-N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]benzenesulfonamide CAS Name: 4-cyano-N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-cyano-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]benzenesulfonamide Traditional Name: 4-cyano-N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]benzenesulfonamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)C#N)N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)C#N)N3CCCCC3

InChI

InChI=1S/C21H25N3O3S/c1-27-19-9-7-18(8-10-19)21(24-13-3-2-4-14-24)16-23-28(25,26)20-11-5-17(15-22)6-12-20/h5-12,21,23H,2-4,13-14,16H2,1H3