(2-chlorophenyl)methylazanium; 2-[(2-chlorophenyl)methyliminomethyl]benzoate

Systemtic Name: (2-chlorophenyl)methylazanium; 2-[(2-chlorophenyl)methyliminomethyl]benzoate Openeye Name: (2-chlorophenyl)methylammonium; 2-[(2-chlorophenyl)methyliminomethyl]benzoate CAS Name: (2-chlorophenyl)methylammonium; 2-[(2-chlorophenyl)methyliminomethyl]benzoate IUPAC Name: (2-chlorophenyl)methylazanium; 2-[(2-chlorophenyl)methyliminomethyl]benzoate Traditional Name: (2-chlorobenzyl)ammonium; 2-[(2-chlorobenzyl)iminomethyl]benzoate Formula: C22H20Cl2N2O2 MolecularWeight: 415.3124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C[NH3+])Cl.C1=CC=C(C(=C1)CN=CC2=CC=CC=C2C(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)C[NH3+])Cl.C1=CC=C(C(=C1)CN=CC2=CC=CC=C2C(=O)[O-])Cl

InChI

InChI=1S/C15H12ClNO2.C7H8ClN/c16-14-8-4-2-6-12(14)10-17-9-11-5-1-3-7-13(11)15(18)19;8-7-4-2-1-3-6(7)5-9/h1-9H,10H2,(H,18,19);1-4H,5,9H2