4-(2-oxidanylbut-3-enylamino)benzenesulfonic acid

Systemtic Name: 4-(2-oxidanylbut-3-enylamino)benzenesulfonic acid Openeye Name: 4-(2-hydroxybut-3-enylamino)benzenesulfonic acid CAS Name: 4-(2-hydroxybut-3-enylamino)benzenesulfonic acid IUPAC Name: 4-(2-hydroxybut-3-enylamino)benzenesulfonic acid Traditional Name: 4-(2-hydroxybut-3-enylamino)besylic acid Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(CNC1=CC=C(C=C1)S(=O)(=O)O)O

Isomeric SMILES

C=CC(CNC1=CC=C(C=C1)S(=O)(=O)O)O

InChI

InChI=1S/C10H13NO4S/c1-2-9(12)7-11-8-3-5-10(6-4-8)16(13,14)15/h2-6,9,11-12H,1,7H2,(H,13,14,15)