[azanylidynemethyl-(4-chlorophenyl)methyl]-(cyanomethyl)-dimethyl-azanium

Systemtic Name: [azanylidynemethyl-(4-chlorophenyl)methyl]-(cyanomethyl)-dimethyl-azanium Openeye Name: [(4-chlorophenyl)-(nitridomethyl)methyl]-(cyanomethyl)-dimethyl-ammonium CAS Name: [(4-chlorophenyl)-(nitrilomethyl)methyl]-(cyanomethyl)-dimethylammonium IUPAC Name: [azanylidynemethyl-(4-chlorophenyl)methyl]-(cyanomethyl)-dimethylazanium Traditional Name: [(4-chlorophenyl)-(nitrilomethyl)methyl]-(cyanomethyl)-dimethyl-ammonium Formula: C12H13ClN3+ MolecularWeight: 235.697375

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC#N)C(C#N)C1=CC=C(C=C1)Cl

Isomeric SMILES

C[N+](C)(CC#N)C([13C]#N)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H13ClN3/c1-16(2,8-7-14)12(9-15)10-3-5-11(13)6-4-10/h3-6,12H,8H2,1-2H3/q+1/i9+1