(E)-6-azanyl-5-oxidanyl-6-oxidanylidene-hex-4-ene-3-sulfonic acid

Systemtic Name: (E)-6-azanyl-5-oxidanyl-6-oxidanylidene-hex-4-ene-3-sulfonic acid Openeye Name: (E)-6-amino-5-hydroxy-6-oxo-hex-4-ene-3-sulfonic acid CAS Name: (E)-6-amino-5-hydroxy-6-oxo-4-hexene-3-sulfonic acid IUPAC Name: (E)-6-amino-5-hydroxy-6-oxohex-4-ene-3-sulfonic acid Traditional Name: (E)-6-amino-5-hydroxy-6-keto-hex-4-ene-3-sulfonic acid Formula: C6H11NO5S MolecularWeight: 209.22024

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=C(C(=O)N)O)S(=O)(=O)O

Isomeric SMILES

CCC(/C=C(\C(=O)N)/O)S(=O)(=O)O

InChI

InChI=1S/C6H11NO5S/c1-2-4(13(10,11)12)3-5(8)6(7)9/h3-4,8H,2H2,1H3,(H2,7,9)(H,10,11,12)/b5-3+