tert-butyl 4-[2-[4-(4-ethylsulfonylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-(4-ethylsulfonylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-(4-ethylsulfonylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[4-(4-ethylsulfonylphenyl)-1-piperazinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-(4-ethylsulfonylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-(4-esylphenyl)piperazino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H39N3O4S MolecularWeight: 465.64916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)N2CCN(CC2)CCC3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)N2CCN(CC2)CCC3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H39N3O4S/c1-5-32(29,30)22-8-6-21(7-9-22)26-18-16-25(17-19-26)13-10-20-11-14-27(15-12-20)23(28)31-24(2,3)4/h6-9,20H,5,10-19H2,1-4H3