(1-oxidanylidene-1-phenyl-propan-2-yl) 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2,3,5,6-tetramethylphenyl)sulfonylisonipecotic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C25H31NO5S MolecularWeight: 457.58234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)OC(C)C(=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)OC(C)C(=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C25H31NO5S/c1-16-15-17(2)19(4)24(18(16)3)32(29,30)26-13-11-22(12-14-26)25(28)31-20(5)23(27)21-9-7-6-8-10-21/h6-10,15,20,22H,11-14H2,1-5H3