3-[[3-oxidanyl-3-oxidanylidene-2-(prop-2-enoylamino)propyl]disulfanyl]-2-(prop-2-enoylamino)propanoic acid

Systemtic Name: 3-[[3-oxidanyl-3-oxidanylidene-2-(prop-2-enoylamino)propyl]disulfanyl]-2-(prop-2-enoylamino)propanoic acid Openeye Name: 3-[[3-hydroxy-3-oxo-2-(prop-2-enoylamino)propyl]disulfanyl]-2-(prop-2-enoylamino)propanoic acid CAS Name: 3-[[3-hydroxy-3-oxo-2-(1-oxoprop-2-enylamino)propyl]disulfanyl]-2-(1-oxoprop-2-enylamino)propanoic acid IUPAC Name: 3-[[3-hydroxy-3-oxo-2-(prop-2-enoylamino)propyl]disulfanyl]-2-(prop-2-enoylamino)propanoic acid Traditional Name: 2-acrylamido-3-[(2-acrylamido-3-hydroxy-3-keto-propyl)disulfanyl]propionic acid Formula: C12H16N2O6S2 MolecularWeight: 348.39524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NC(CSSCC(C(=O)O)NC(=O)C=C)C(=O)O

Isomeric SMILES

C=CC(=O)NC(CSSCC(C(=O)O)NC(=O)C=C)C(=O)O

InChI

InChI=1S/C12H16N2O6S2/c1-3-9(15)13-7(11(17)18)5-21-22-6-8(12(19)20)14-10(16)4-2/h3-4,7-8H,1-2,5-6H2,(H,13,15)(H,14,16)(H,17,18)(H,19,20)