tert-butyl 4-[3-(4-methylsulfonylphenyl)propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(4-methylsulfonylphenyl)propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-(4-methylsulfonylphenyl)propyl]piperidine-1-carboxylate CAS Name: 4-[3-(4-methylsulfonylphenyl)propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(4-methylsulfonylphenyl)propyl]piperidine-1-carboxylate Traditional Name: 4-[3-(4-mesylphenyl)propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H31NO4S MolecularWeight: 381.52944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCCC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCCC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C20H31NO4S/c1-20(2,3)25-19(22)21-14-12-17(13-15-21)7-5-6-16-8-10-18(11-9-16)26(4,23)24/h8-11,17H,5-7,12-15H2,1-4H3