4-(3-oxidanylpropylamino)benzenesulfonic acid

Systemtic Name: 4-(3-oxidanylpropylamino)benzenesulfonic acid Openeye Name: 4-(3-hydroxypropylamino)benzenesulfonic acid CAS Name: 4-(3-hydroxypropylamino)benzenesulfonic acid IUPAC Name: 4-(3-hydroxypropylamino)benzenesulfonic acid Traditional Name: 4-(3-hydroxypropylamino)besylic acid Formula: C9H13NO4S MolecularWeight: 231.26882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCCO)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1NCCCO)S(=O)(=O)O

InChI

InChI=1S/C9H13NO4S/c11-7-1-6-10-8-2-4-9(5-3-8)15(12,13)14/h2-5,10-11H,1,6-7H2,(H,12,13,14)