1-(2-propan-2-ylsulfanylethanoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 1-(2-propan-2-ylsulfanylethanoylamino)cyclohexane-1-carboxylic acid Openeye Name: 1-[(2-isopropylsulfanylacetyl)amino]cyclohexanecarboxylic acid CAS Name: 1-[[1-oxo-2-(propan-2-ylthio)ethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(2-propan-2-ylsulfanylacetyl)amino]cyclohexane-1-carboxylic acid Traditional Name: 1-[[2-(isopropylthio)acetyl]amino]cyclohexanecarboxylic acid Formula: C12H21NO3S MolecularWeight: 259.36504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC(=O)NC1(CCCCC1)C(=O)O

Isomeric SMILES

CC(C)SCC(=O)NC1(CCCCC1)C(=O)O

InChI

InChI=1S/C12H21NO3S/c1-9(2)17-8-10(14)13-12(11(15)16)6-4-3-5-7-12/h9H,3-8H2,1-2H3,(H,13,14)(H,15,16)