O1-tert-butyl O4-(phenylmethyl) 3-(methylsulfonyloxymethyl)piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-(phenylmethyl) 3-(methylsulfonyloxymethyl)piperidine-1,4-dicarboxylate Openeye Name: O4-benzyl O1-tert-butyl 3-(methylsulfonyloxymethyl)piperidine-1,4-dicarboxylate CAS Name: 3-(methylsulfonyloxymethyl)piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 1-O-tert-butyl 3-(methylsulfonyloxymethyl)piperidine-1,4-dicarboxylate Traditional Name: 3-(methylsulfonyloxymethyl)piperidine-1,4-dicarboxylic acid O4-benzyl ester O1-tert-butyl ester Formula: C20H29NO7S MolecularWeight: 427.51176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(C1)COS(=O)(=O)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C(C1)COS(=O)(=O)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H29NO7S/c1-20(2,3)28-19(23)21-11-10-17(16(12-21)14-27-29(4,24)25)18(22)26-13-15-8-6-5-7-9-15/h5-9,16-17H,10-14H2,1-4H3