O1-tert-butyl O4-ethyl 4-[[3-(methylsulfonylamino)phenyl]methyl]piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-ethyl 4-[[3-(methylsulfonylamino)phenyl]methyl]piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-ethyl 4-[[3-(methanesulfonamido)phenyl]methyl]piperidine-1,4-dicarboxylate CAS Name: 4-[[3-(methanesulfonamido)phenyl]methyl]piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-ethyl ester IUPAC Name: 1-O-tert-butyl 4-O-ethyl 4-[[3-(methanesulfonamido)phenyl]methyl]piperidine-1,4-dicarboxylate Traditional Name: 4-[3-(methanesulfonamido)benzyl]piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-ethyl ester Formula: C21H32N2O6S MolecularWeight: 440.55358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)CC2=CC(=CC=C2)NS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)CC2=CC(=CC=C2)NS(=O)(=O)C

InChI

InChI=1S/C21H32N2O6S/c1-6-28-18(24)21(10-12-23(13-11-21)19(25)29-20(2,3)4)15-16-8-7-9-17(14-16)22-30(5,26)27/h7-9,14,22H,6,10-13,15H2,1-5H3