4-[(3-methoxy-2-oxidanyl-propyl)amino]benzenesulfonic acid

Systemtic Name: 4-[(3-methoxy-2-oxidanyl-propyl)amino]benzenesulfonic acid Openeye Name: 4-[(2-hydroxy-3-methoxy-propyl)amino]benzenesulfonic acid CAS Name: 4-[(2-hydroxy-3-methoxypropyl)amino]benzenesulfonic acid IUPAC Name: 4-[(2-hydroxy-3-methoxypropyl)amino]benzenesulfonic acid Traditional Name: 4-[(2-hydroxy-3-methoxy-propyl)amino]besylic acid Formula: C10H15NO5S MolecularWeight: 261.2948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H15NO5S/c1-16-7-9(12)6-11-8-2-4-10(5-3-8)17(13,14)15/h2-5,9,11-12H,6-7H2,1H3,(H,13,14,15)