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

Systemtic Name: tert-butyl 4-[2-[4-(4-sulfamoylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-(4-sulfamoylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[4-(4-sulfamoylphenyl)-1-piperazinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-(4-sulfamoylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-(4-sulfamoylphenyl)piperazino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H36N4O4S MolecularWeight: 452.61064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H36N4O4S/c1-22(2,3)30-21(27)26-12-9-18(10-13-26)8-11-24-14-16-25(17-15-24)19-4-6-20(7-5-19)31(23,28)29/h4-7,18H,8-17H2,1-3H3,(H2,23,28,29)