(4-oxidanylidene-4-thiophen-2-yl-butyl) 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxylic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2,3,5,6-tetramethylphenyl)sulfonylisonipecotic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C24H31NO5S2 MolecularWeight: 477.63664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)OCCCC(=O)C3=CC=CS3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)OCCCC(=O)C3=CC=CS3)C)C

InChI

InChI=1S/C24H31NO5S2/c1-16-15-17(2)19(4)23(18(16)3)32(28,29)25-11-9-20(10-12-25)24(27)30-13-5-7-21(26)22-8-6-14-31-22/h6,8,14-15,20H,5,7,9-13H2,1-4H3