1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylic acid CAS Name: 1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-(2,3,5,6-tetramethylphenyl)sulfonylisonipecotic acid Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO4S/c1-10-9-11(2)13(4)15(12(10)3)22(20,21)17-7-5-14(6-8-17)16(18)19/h9,14H,5-8H2,1-4H3,(H,18,19)