1-(2,5-dimethylthiophen-3-yl)sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-[(2,5-dimethyl-3-thienyl)sulfonyl]piperidine-4-carboxylic acid CAS Name: 1-[(2,5-dimethyl-3-thiophenyl)sulfonyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2,5-dimethylthiophen-3-yl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-[(2,5-dimethyl-3-thienyl)sulfonyl]isonipecotic acid Formula: C12H17NO4S2 MolecularWeight: 303.39768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)S(=O)(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)C)S(=O)(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C12H17NO4S2/c1-8-7-11(9(2)18-8)19(16,17)13-5-3-10(4-6-13)12(14)15/h7,10H,3-6H2,1-2H3,(H,14,15)