4-ethyl-1-(3-methylsulfonylpropanoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 4-ethyl-1-(3-methylsulfonylpropanoylamino)cyclohexane-1-carboxylic acid Openeye Name: 4-ethyl-1-(3-methylsulfonylpropanoylamino)cyclohexanecarboxylic acid CAS Name: 4-ethyl-1-[(3-methylsulfonyl-1-oxopropyl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-ethyl-1-(3-methylsulfonylpropanoylamino)cyclohexane-1-carboxylic acid Traditional Name: 4-ethyl-1-(3-mesylpropanoylamino)cyclohexanecarboxylic acid Formula: C13H23NO5S MolecularWeight: 305.39042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)(C(=O)O)NC(=O)CCS(=O)(=O)C

Isomeric SMILES

CCC1CCC(CC1)(C(=O)O)NC(=O)CCS(=O)(=O)C

InChI

InChI=1S/C13H23NO5S/c1-3-10-4-7-13(8-5-10,12(16)17)14-11(15)6-9-20(2,18)19/h10H,3-9H2,1-2H3,(H,14,15)(H,16,17)