2,6-bis(oxidanyl)benzoate; (phenylmethyl)azanium

Systemtic Name: 2,6-bis(oxidanyl)benzoate; (phenylmethyl)azanium Openeye Name: benzylammonium; 2,6-dihydroxybenzoate CAS Name: 2,6-dihydroxybenzoate; (phenylmethyl)ammonium IUPAC Name: benzylazanium; 2,6-dihydroxybenzoate Traditional Name: benzylammonium; 2,6-dihydroxybenzoate Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9N.C7H6O4/c8-6-7-4-2-1-3-5-7;8-4-2-1-3-5(9)6(4)7(10)11/h1-5H,6,8H2;1-3,8-9H,(H,10,11)