(1-oxidanylidene-1-phenyl-propan-2-yl) 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-piperidinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 1-(4-ethoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-p-phenetylsulfonylisonipecotic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C23H27NO6S MolecularWeight: 445.52858

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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)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC(C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H27NO6S/c1-3-29-20-9-11-21(12-10-20)31(27,28)24-15-13-19(14-16-24)23(26)30-17(2)22(25)18-7-5-4-6-8-18/h4-12,17,19H,3,13-16H2,1-2H3