tert-butyl 3-(3,4-dichlorophenyl)-3-(3-methylsulfonyloxypropyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-(3,4-dichlorophenyl)-3-(3-methylsulfonyloxypropyl)piperidine-1-carboxylate Openeye Name: tert-butyl 3-(3,4-dichlorophenyl)-3-(3-methylsulfonyloxypropyl)piperidine-1-carboxylate CAS Name: 3-(3,4-dichlorophenyl)-3-(3-methylsulfonyloxypropyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3,4-dichlorophenyl)-3-(3-methylsulfonyloxypropyl)piperidine-1-carboxylate Traditional Name: 3-(3,4-dichlorophenyl)-3-(3-methylsulfonyloxypropyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C20H29Cl2NO5S MolecularWeight: 466.41896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)(CCCOS(=O)(=O)C)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)(CCCOS(=O)(=O)C)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C20H29Cl2NO5S/c1-19(2,3)28-18(24)23-11-5-9-20(14-23,10-6-12-27-29(4,25)26)15-7-8-16(21)17(22)13-15/h7-8,13H,5-6,9-12,14H2,1-4H3