2-oxidanylbenzoate; 2-(phenylmethyl)sulfinylethylazanium

Systemtic Name: 2-oxidanylbenzoate; 2-(phenylmethyl)sulfinylethylazanium Openeye Name: 2-benzylsulfinylethylammonium; 2-hydroxybenzoate CAS Name: 2-hydroxybenzoate; 2-(phenylmethyl)sulfinylethylammonium IUPAC Name: 2-benzylsulfinylethylazanium; 2-hydroxybenzoate Traditional Name: 2-benzylsulfinylethylammonium; salicylate Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13NOS.C7H6O3/c10-6-7-12(11)8-9-4-2-1-3-5-9;8-6-4-2-1-3-5(6)7(9)10/h1-5H,6-8,10H2;1-4,8H,(H,9,10)