tert-butyl 2-(2-methylsulfonylphenyl)-4-(2-oxidanylideneethyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-(2-methylsulfonylphenyl)-4-(2-oxidanylideneethyl)piperidine-1-carboxylate Openeye Name: tert-butyl 2-(2-methylsulfonylphenyl)-4-(2-oxoethyl)piperidine-1-carboxylate CAS Name: 2-(2-methylsulfonylphenyl)-4-(2-oxoethyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2-methylsulfonylphenyl)-4-(2-oxoethyl)piperidine-1-carboxylate Traditional Name: 4-(2-ketoethyl)-2-(2-mesylphenyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C19H27NO5S MolecularWeight: 381.48638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1C2=CC=CC=C2S(=O)(=O)C)CC=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1C2=CC=CC=C2S(=O)(=O)C)CC=O

InChI

InChI=1S/C19H27NO5S/c1-19(2,3)25-18(22)20-11-9-14(10-12-21)13-16(20)15-7-5-6-8-17(15)26(4,23)24/h5-8,12,14,16H,9-11,13H2,1-4H3