dimethyl-bis(8-methylnonyl)azanium; methyl sulfate

Systemtic Name: dimethyl-bis(8-methylnonyl)azanium; methyl sulfate Openeye Name: dimethyl-bis(8-methylnonyl)ammonium; methyl sulfate CAS Name: dimethyl-bis(8-methylnonyl)ammonium; methyl sulfate IUPAC Name: dimethyl-bis(8-methylnonyl)azanium; methyl sulfate Traditional Name: dimethyl-bis(8-methylnonyl)ammonium; methyl sulfate Formula: C23H51NO4S MolecularWeight: 437.72034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCC[N+](C)(C)CCCCCCCC(C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC(C)CCCCCCC[N+](C)(C)CCCCCCCC(C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C22H48N.CH4O4S/c1-21(2)17-13-9-7-11-15-19-23(5,6)20-16-12-8-10-14-18-22(3)4;1-5-6(2,3)4/h21-22H,7-20H2,1-6H3;1H3,(H,2,3,4)/q+1;/p-1