(2-oxidanylidene-2-propan-2-yloxy-ethyl) 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxylic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-methoxyphenyl)sulfonylisonipecotic acid (2-isopropoxy-2-keto-ethyl) ester Formula: C18H25NO7S MolecularWeight: 399.4586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)COC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)OC(=O)COC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H25NO7S/c1-13(2)26-17(20)12-25-18(21)14-8-10-19(11-9-14)27(22,23)16-6-4-15(24-3)5-7-16/h4-7,13-14H,8-12H2,1-3H3