3-oxidanylidenebutan-2-yl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 3-oxidanylidenebutan-2-yl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (1-methyl-2-oxo-propyl) 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-piperidinecarboxylic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-p-phenetylsulfonylisonipecotic acid (2-keto-1-methyl-propyl) ester Formula: C18H25NO6S MolecularWeight: 383.4592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC(C)C(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC(C)C(=O)C

InChI

InChI=1S/C18H25NO6S/c1-4-24-16-5-7-17(8-6-16)26(22,23)19-11-9-15(10-12-19)18(21)25-14(3)13(2)20/h5-8,14-15H,4,9-12H2,1-3H3