3,4-dimethoxy-N-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[2-[4-(1-piperidylsulfonyl)phenyl]ethyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[2-[4-(1-piperidinylsulfonyl)phenyl]ethyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[2-(4-piperidinosulfonylphenyl)ethyl]benzenesulfonamide Formula: C21H28N2O6S2 MolecularWeight: 468.58682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)OC

InChI

InChI=1S/C21H28N2O6S2/c1-28-20-11-10-19(16-21(20)29-2)30(24,25)22-13-12-17-6-8-18(9-7-17)31(26,27)23-14-4-3-5-15-23/h6-11,16,22H,3-5,12-15H2,1-2H3