bis(phenylmethyl)azanium benzoate

Systemtic Name: bis(phenylmethyl)azanium benzoate Openeye Name: dibenzylammonium benzoate CAS Name: bis(phenylmethyl)ammonium benzoate IUPAC Name: dibenzylazanium benzoate Traditional Name: dibenzylammonium benzoate Formula: C21H21NO2 MolecularWeight: 319.39694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]CC2=CC=CC=C2.C1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]CC2=CC=CC=C2.C1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C14H15N.C7H6O2/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;8-7(9)6-4-2-1-3-5-6/h1-10,15H,11-12H2;1-5H,(H,8,9)