2-azanyl-3-sulfanyl-propanoic acid; furan-2-carbaldehyde

Systemtic Name: 2-azanyl-3-sulfanyl-propanoic acid; furan-2-carbaldehyde Openeye Name: 2-amino-3-sulfanyl-propanoic acid; furan-2-carbaldehyde CAS Name: 2-amino-3-mercaptopropanoic acid; 2-furancarboxaldehyde IUPAC Name: 2-amino-3-sulfanylpropanoic acid; furan-2-carbaldehyde Traditional Name: 2-amino-3-mercapto-propionic acid; furfural Formula: C8H11NO4S MolecularWeight: 217.24224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C=O.C(C(C(=O)O)N)S

Isomeric SMILES

C1=COC(=C1)C=O.C(C(C(=O)O)N)S

InChI

InChI=1S/C5H4O2.C3H7NO2S/c6-4-5-2-1-3-7-5;4-2(1-7)3(5)6/h1-4H;2,7H,1,4H2,(H,5,6)