ethyl 1-[4-(2-methoxy-2-oxidanylidene-ethoxy)-3-methyl-phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-(2-methoxy-2-oxidanylidene-ethoxy)-3-methyl-phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-(2-methoxy-2-oxo-ethoxy)-3-methyl-phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-(2-methoxy-2-oxoethoxy)-3-methylphenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(2-methoxy-2-oxoethoxy)-3-methylphenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[4-(2-keto-2-methoxy-ethoxy)-3-methyl-phenyl]sulfonylisonipecotic acid ethyl ester Formula: C18H25NO7S MolecularWeight: 399.4586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)OC)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)OC)C

InChI

InChI=1S/C18H25NO7S/c1-4-25-18(21)14-7-9-19(10-8-14)27(22,23)15-5-6-16(13(2)11-15)26-12-17(20)24-3/h5-6,11,14H,4,7-10,12H2,1-3H3