tert-butyl 4-[4-(phenylsulfonyl)piperazin-1-yl]carbonylpiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(phenylsulfonyl)piperazin-1-yl]carbonylpiperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(benzenesulfonyl)piperazine-1-carbonyl]piperidine-1-carboxylate CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(benzenesulfonyl)piperazine-1-carbonyl]piperidine-1-carboxylate Traditional Name: 4-(4-besylpiperazine-1-carbonyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H31N3O5S/c1-21(2,3)29-20(26)23-11-9-17(10-12-23)19(25)22-13-15-24(16-14-22)30(27,28)18-7-5-4-6-8-18/h4-8,17H,9-16H2,1-3H3