oxolan-2-ylmethyl 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: oxolan-2-ylmethyl 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2,3,5,6-tetramethylphenyl)sulfonylisonipecotic acid tetrahydrofurfuryl ester Formula: C21H31NO5S MolecularWeight: 409.53954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)OCC3CCCO3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)OCC3CCCO3)C)C

InChI

InChI=1S/C21H31NO5S/c1-14-12-15(2)17(4)20(16(14)3)28(24,25)22-9-7-18(8-10-22)21(23)27-13-19-6-5-11-26-19/h12,18-19H,5-11,13H2,1-4H3