tert-butyl 2-aminocarbonyl-2-tert-butyl-4-(phenylsulfinyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-aminocarbonyl-2-tert-butyl-4-(phenylsulfinyl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(benzenesulfinyl)-2-tert-butyl-2-carbamoyl-piperidine-1-carboxylate CAS Name: 4-(benzenesulfinyl)-2-tert-butyl-2-carbamoyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(benzenesulfinyl)-2-tert-butyl-2-carbamoylpiperidine-1-carboxylate Traditional Name: 4-(benzenesulfinyl)-2-tert-butyl-2-carbamoyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C21H32N2O4S MolecularWeight: 408.55478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CC(CCN1C(=O)OC(C)(C)C)S(=O)C2=CC=CC=C2)C(=O)N

Isomeric SMILES

CC(C)(C)C1(CC(CCN1C(=O)OC(C)(C)C)S(=O)C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C21H32N2O4S/c1-19(2,3)21(17(22)24)14-16(28(26)15-10-8-7-9-11-15)12-13-23(21)18(25)27-20(4,5)6/h7-11,16H,12-14H2,1-6H3,(H2,22,24)