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

Systemtic Name: 2-[(3-cyclooctylsulfanyl-1-ethoxy-1-oxidanylidene-propan-2-yl)amino]propanoic acid Openeye Name: 2-[[1-(cyclooctylsulfanylmethyl)-2-ethoxy-2-oxo-ethyl]amino]propanoic acid CAS Name: 2-[[3-(cyclooctylthio)-1-ethoxy-1-oxopropan-2-yl]amino]propanoic acid IUPAC Name: 2-[(3-cyclooctylsulfanyl-1-ethoxy-1-oxopropan-2-yl)amino]propanoic acid Traditional Name: 2-[[1-[(cyclooctylthio)methyl]-2-ethoxy-2-keto-ethyl]amino]propionic acid Formula: C16H29NO4S MolecularWeight: 331.47076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC1CCCCCCC1)NC(C)C(=O)O

Isomeric SMILES

CCOC(=O)C(CSC1CCCCCCC1)NC(C)C(=O)O

InChI

InChI=1S/C16H29NO4S/c1-3-21-16(20)14(17-12(2)15(18)19)11-22-13-9-7-5-4-6-8-10-13/h12-14,17H,3-11H2,1-2H3,(H,18,19)