5-[(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)sulfanylmethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)sulfanylmethyl]furan-2-carboxylic acid Openeye Name: 5-[(2-amino-3-hydroxy-3-oxo-propyl)sulfanylmethyl]furan-2-carboxylic acid CAS Name: 5-[[(2-amino-3-hydroxy-3-oxopropyl)thio]methyl]-2-furancarboxylic acid IUPAC Name: 5-[(2-amino-3-hydroxy-3-oxopropyl)sulfanylmethyl]furan-2-carboxylic acid Traditional Name: 5-[[(2-amino-3-hydroxy-3-keto-propyl)thio]methyl]-2-furoic acid Formula: C9H11NO5S MolecularWeight: 245.25234

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)C(=O)O)CSCC(C(=O)O)N

Isomeric SMILES

C1=C(OC(=C1)C(=O)O)CSCC(C(=O)O)N

InChI

InChI=1S/C9H11NO5S/c10-6(8(11)12)4-16-3-5-1-2-7(15-5)9(13)14/h1-2,6H,3-4,10H2,(H,11,12)(H,13,14)