N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-propyl-benzenesulfonamide

Systemtic Name: N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-propyl-benzenesulfonamide Openeye Name: N-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-4-propyl-benzenesulfonamide CAS Name: N-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-4-propylbenzenesulfonamide IUPAC Name: N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-propylbenzenesulfonamide Traditional Name: N-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-4-propyl-benzenesulfonamide Formula: C21H28N2O5S2 MolecularWeight: 452.58742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H28N2O5S2/c1-3-4-17-5-9-20(10-6-17)29(24,25)22-18-13-15-23(16-14-18)30(26,27)21-11-7-19(28-2)8-12-21/h5-12,18,22H,3-4,13-16H2,1-2H3