2-[[1-ethoxy-3-(1-methylcyclohexyl)sulfanyl-1-oxidanylidene-propan-2-yl]amino]propanoic acid

Systemtic Name: 2-[[1-ethoxy-3-(1-methylcyclohexyl)sulfanyl-1-oxidanylidene-propan-2-yl]amino]propanoic acid Openeye Name: 2-[[2-ethoxy-1-[(1-methylcyclohexyl)sulfanylmethyl]-2-oxo-ethyl]amino]propanoic acid CAS Name: 2-[[1-ethoxy-3-[(1-methylcyclohexyl)thio]-1-oxopropan-2-yl]amino]propanoic acid IUPAC Name: 2-[[1-ethoxy-3-(1-methylcyclohexyl)sulfanyl-1-oxopropan-2-yl]amino]propanoic acid Traditional Name: 2-[[2-ethoxy-2-keto-1-[[(1-methylcyclohexyl)thio]methyl]ethyl]amino]propionic acid Formula: C15H27NO4S MolecularWeight: 317.44418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC1(CCCCC1)C)NC(C)C(=O)O

Isomeric SMILES

CCOC(=O)C(CSC1(CCCCC1)C)NC(C)C(=O)O

InChI

InChI=1S/C15H27NO4S/c1-4-20-14(19)12(16-11(2)13(17)18)10-21-15(3)8-6-5-7-9-15/h11-12,16H,4-10H2,1-3H3,(H,17,18)