tert-butyl (3S,4S)-4-(methylsulfonyloxymethyl)-3-[[(1R)-1-phenylethyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl (3S,4S)-4-(methylsulfonyloxymethyl)-3-[[(1R)-1-phenylethyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl (3S,4S)-4-(methylsulfonyloxymethyl)-3-[[(1R)-1-phenylethyl]amino]piperidine-1-carboxylate CAS Name: (3S,4S)-4-(methylsulfonyloxymethyl)-3-[[(1R)-1-phenylethyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4S)-4-(methylsulfonyloxymethyl)-3-[[(1R)-1-phenylethyl]amino]piperidine-1-carboxylate Traditional Name: (3S,4S)-4-(methylsulfonyloxymethyl)-3-[[(1R)-1-phenylethyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H32N2O5S MolecularWeight: 412.54348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2CN(CCC2COS(=O)(=O)C)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N[C@@H]2CN(CC[C@@H]2COS(=O)(=O)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H32N2O5S/c1-15(16-9-7-6-8-10-16)21-18-13-22(19(23)27-20(2,3)4)12-11-17(18)14-26-28(5,24)25/h6-10,15,17-18,21H,11-14H2,1-5H3/t15-,17-,18-/m1/s1