propan-2-yl 4-[1-(3-methylsulfonylphenyl)-2-oxidanylidene-pyridin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[1-(3-methylsulfonylphenyl)-2-oxidanylidene-pyridin-4-yl]oxypiperidine-1-carboxylate Openeye Name: isopropyl 4-[[1-(3-methylsulfonylphenyl)-2-oxo-4-pyridyl]oxy]piperidine-1-carboxylate CAS Name: 4-[[1-(3-methylsulfonylphenyl)-2-oxo-4-pyridinyl]oxy]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[1-(3-methylsulfonylphenyl)-2-oxopyridin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[[2-keto-1-(3-mesylphenyl)-4-pyridyl]oxy]piperidine-1-carboxylic acid isopropyl ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)OC2=CC(=O)N(C=C2)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)OC2=CC(=O)N(C=C2)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O6S/c1-15(2)28-21(25)22-10-7-17(8-11-22)29-18-9-12-23(20(24)14-18)16-5-4-6-19(13-16)30(3,26)27/h4-6,9,12-15,17H,7-8,10-11H2,1-3H3