dimethyl-[(E)-5-oxidanylidenedocos-13-en-4-yl]azanium sulfate

Systemtic Name: dimethyl-[(E)-5-oxidanylidenedocos-13-en-4-yl]azanium sulfate Openeye Name: dimethyl-[(E)-2-oxo-1-propyl-nonadec-10-enyl]ammonium sulfate CAS Name: dimethyl-[(E)-5-oxodocos-13-en-4-yl]ammonium sulfate IUPAC Name: dimethyl-[(E)-5-oxodocos-13-en-4-yl]azanium sulfate Traditional Name: [(E)-2-keto-1-propyl-nonadec-10-enyl]-dimethyl-ammonium sulfate Formula: C24H48NO5S- MolecularWeight: 462.70662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C(CCC)[NH+](C)C.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C(CCC)[NH+](C)C.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C24H47NO.H2O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-24(26)23(21-6-2)25(3)4;1-5(2,3)4/h13-14,23H,5-12,15-22H2,1-4H3;(H2,1,2,3,4)/p-1/b14-13+;