didecyl(dimethyl)azanium; dodecyl-dimethyl-(phenylmethyl)azanium; dichloride

Systemtic Name: didecyl(dimethyl)azanium; dodecyl-dimethyl-(phenylmethyl)azanium; dichloride Openeye Name: benzyl-dodecyl-dimethyl-ammonium; didecyl(dimethyl)ammonium; dichloride CAS Name: didecyl(dimethyl)ammonium; dodecyl-dimethyl-(phenylmethyl)ammonium; dichloride IUPAC Name: benzyl-dodecyl-dimethylazanium; didecyl(dimethyl)azanium; dichloride Traditional Name: benzyl-lauryl-dimethyl-ammonium; didecyl(dimethyl)ammonium; dichloride Formula: C43H86Cl2N2 MolecularWeight: 702.06234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.[Cl-].[Cl-]

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.[Cl-].[Cl-]

InChI

InChI=1S/C22H48N.C21H38N.2ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;1-4-5-6-7-8-9-10-11-12-16-19-22(2,3)20-21-17-14-13-15-18-21;;/h5-22H2,1-4H3;13-15,17-18H,4-12,16,19-20H2,1-3H3;2*1H/q2*+1;;/p-2