(E)-2,3-bis(azanyl)-4-[2-(2-hydroxyethyloxy)ethylsulfanyl]but-2-enoic acid

Systemtic Name: (E)-2,3-bis(azanyl)-4-[2-(2-hydroxyethyloxy)ethylsulfanyl]but-2-enoic acid Openeye Name: (E)-2,3-diamino-4-[2-(2-hydroxyethoxy)ethylsulfanyl]but-2-enoic acid CAS Name: (E)-2,3-diamino-4-[2-(2-hydroxyethoxy)ethylthio]-2-butenoic acid IUPAC Name: (E)-2,3-diamino-4-[2-(2-hydroxyethoxy)ethylsulfanyl]but-2-enoic acid Traditional Name: (E)-2,3-diamino-4-[2-(2-hydroxyethoxy)ethylthio]but-2-enoic acid Formula: C8H16N2O4S MolecularWeight: 236.28864

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Descriptors Computed from Structure

Canonical SMILES:

C(COCCSCC(=C(C(=O)O)N)N)O

Isomeric SMILES

C(COCCSC/C(=C(/C(=O)O)\N)/N)O

InChI

InChI=1S/C8H16N2O4S/c9-6(7(10)8(12)13)5-15-4-3-14-2-1-11/h11H,1-5,9-10H2,(H,12,13)/b7-6+