(1-chloranyl-4-oxidanyl-4-oxidanylidene-butyl)-cyano-dimethyl-azanium

Systemtic Name: (1-chloranyl-4-oxidanyl-4-oxidanylidene-butyl)-cyano-dimethyl-azanium Openeye Name: (1-chloro-4-hydroxy-4-oxo-butyl)-cyano-dimethyl-ammonium CAS Name: (1-chloro-4-hydroxy-4-oxobutyl)-cyano-dimethylammonium IUPAC Name: (1-chloro-4-hydroxy-4-oxobutyl)-cyano-dimethylazanium Traditional Name: (1-chloro-4-hydroxy-4-keto-butyl)-cyano-dimethyl-ammonium Formula: C7H12ClN2O2+ MolecularWeight: 191.63538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C#N)C(CCC(=O)O)Cl

Isomeric SMILES

C[N+](C)(C#N)C(CCC(=O)O)Cl

InChI

InChI=1S/C7H11ClN2O2/c1-10(2,5-9)6(8)3-4-7(11)12/h6H,3-4H2,1-2H3/p+1