(3,4-dichlorophenyl)methyl-dimethyl-(1-oxidanylidene-1-propoxy-dodecan-2-yl)azanium chloride

Systemtic Name: (3,4-dichlorophenyl)methyl-dimethyl-(1-oxidanylidene-1-propoxy-dodecan-2-yl)azanium chloride Openeye Name: (3,4-dichlorophenyl)methyl-dimethyl-(1-propoxycarbonylundecyl)ammonium chloride CAS Name: (3,4-dichlorophenyl)methyl-dimethyl-(1-oxo-1-propoxydodecan-2-yl)ammonium chloride IUPAC Name: (3,4-dichlorophenyl)methyl-dimethyl-(1-oxo-1-propoxydodecan-2-yl)azanium chloride Traditional Name: (3,4-dichlorobenzyl)-dimethyl-(1-propoxycarbonylundecyl)ammonium chloride Formula: C24H40Cl3NO2 MolecularWeight: 480.9389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(=O)OCCC)[N+](C)(C)CC1=CC(=C(C=C1)Cl)Cl.[Cl-]

Isomeric SMILES

CCCCCCCCCCC(C(=O)OCCC)[N+](C)(C)CC1=CC(=C(C=C1)Cl)Cl.[Cl-]

InChI

InChI=1S/C24H40Cl2NO2.ClH/c1-5-7-8-9-10-11-12-13-14-23(24(28)29-17-6-2)27(3,4)19-20-15-16-21(25)22(26)18-20;/h15-16,18,23H,5-14,17,19H2,1-4H3;1H/q+1;/p-1