2-oxidanylbenzenesulfonate; (phenylmethyl)azanium

Systemtic Name: 2-oxidanylbenzenesulfonate; (phenylmethyl)azanium Openeye Name: benzylammonium; 2-hydroxybenzenesulfonate CAS Name: 2-hydroxybenzenesulfonate; (phenylmethyl)ammonium IUPAC Name: benzylazanium; 2-hydroxybenzenesulfonate Traditional Name: benzylammonium; 2-hydroxybesylate Formula: C13H15NO4S MolecularWeight: 281.3275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH3+].C1=CC=C(C(=C1)O)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[NH3+].C1=CC=C(C(=C1)O)S(=O)(=O)[O-]

InChI

InChI=1S/C7H9N.C6H6O4S/c8-6-7-4-2-1-3-5-7;7-5-3-1-2-4-6(5)11(8,9)10/h1-5H,6,8H2;1-4,7H,(H,8,9,10)