propan-2-yl 4-[[1-(4-methylsulfonylphenyl)-2-oxidanylidene-pyridin-4-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[[1-(4-methylsulfonylphenyl)-2-oxidanylidene-pyridin-4-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridyl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[1-(4-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxymethyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[1-(4-methylsulfonylphenyl)-2-oxopyridin-4-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[2-keto-1-(4-mesylphenyl)-4-pyridyl]oxymethyl]piperidine-1-carboxylic acid isopropyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)COC2=CC(=O)N(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)COC2=CC(=O)N(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H28N2O6S/c1-16(2)30-22(26)23-11-8-17(9-12-23)15-29-19-10-13-24(21(25)14-19)18-4-6-20(7-5-18)31(3,27)28/h4-7,10,13-14,16-17H,8-9,11-12,15H2,1-3H3