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

Systemtic Name: 2-[[1-ethoxy-1-oxidanylidene-3-(phenyldisulfanyl)propan-2-yl]amino]propanoic acid Openeye Name: 2-[[2-ethoxy-2-oxo-1-[(phenyldisulfanyl)methyl]ethyl]amino]propanoic acid CAS Name: 2-[[1-ethoxy-1-oxo-3-(phenyldisulfanyl)propan-2-yl]amino]propanoic acid IUPAC Name: 2-[[1-ethoxy-1-oxo-3-(phenyldisulfanyl)propan-2-yl]amino]propanoic acid Traditional Name: 2-[[2-ethoxy-2-keto-1-[(phenyldisulfanyl)methyl]ethyl]amino]propionic acid Formula: C14H19NO4S2 MolecularWeight: 329.43496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSSC1=CC=CC=C1)NC(C)C(=O)O

Isomeric SMILES

CCOC(=O)C(CSSC1=CC=CC=C1)NC(C)C(=O)O

InChI

InChI=1S/C14H19NO4S2/c1-3-19-14(18)12(15-10(2)13(16)17)9-20-21-11-7-5-4-6-8-11/h4-8,10,12,15H,3,9H2,1-2H3,(H,16,17)