tert-butyl 4-[3-[4-(5-chloranylpyridin-2-yl)oxypiperidin-1-yl]sulfonyl-2-oxidanylidene-propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[4-(5-chloranylpyridin-2-yl)oxypiperidin-1-yl]sulfonyl-2-oxidanylidene-propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-[[4-[(5-chloro-2-pyridyl)oxy]-1-piperidyl]sulfonyl]-2-oxo-propyl]piperidine-1-carboxylate CAS Name: 4-[3-[[4-[(5-chloro-2-pyridinyl)oxy]-1-piperidinyl]sulfonyl]-2-oxopropyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[4-(5-chloropyridin-2-yl)oxypiperidin-1-yl]sulfonyl-2-oxopropyl]piperidine-1-carboxylate Traditional Name: 4-[3-[4-[(5-chloro-2-pyridyl)oxy]piperidino]sulfonyl-2-keto-propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H34ClN3O6S MolecularWeight: 516.05056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CC(=O)CS(=O)(=O)N2CCC(CC2)OC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CC(=O)CS(=O)(=O)N2CCC(CC2)OC3=NC=C(C=C3)Cl

InChI

InChI=1S/C23H34ClN3O6S/c1-23(2,3)33-22(29)26-10-6-17(7-11-26)14-19(28)16-34(30,31)27-12-8-20(9-13-27)32-21-5-4-18(24)15-25-21/h4-5,15,17,20H,6-14,16H2,1-3H3