tert-butyl 3-[[methylsulfonyl(phenyl)amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[methylsulfonyl(phenyl)amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(N-methylsulfonylanilino)methyl]piperidine-1-carboxylate CAS Name: 3-[(N-methylsulfonylanilino)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(N-methylsulfonylanilino)methyl]piperidine-1-carboxylate Traditional Name: 3-[(N-mesylanilino)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H28N2O4S MolecularWeight: 368.49092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)CN(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CN(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C18H28N2O4S/c1-18(2,3)24-17(21)19-12-8-9-15(13-19)14-20(25(4,22)23)16-10-6-5-7-11-16/h5-7,10-11,15H,8-9,12-14H2,1-4H3