1-methyl-4-tetradecan-2-yl-benzene; trimethylazanium; dichloride

Systemtic Name: 1-methyl-4-tetradecan-2-yl-benzene; trimethylazanium; dichloride Openeye Name: 1-methyl-4-(1-methyltridecyl)benzene; trimethylammonium; dichloride CAS Name: 1-methyl-4-tetradecan-2-ylbenzene; trimethylammonium; dichloride IUPAC Name: 1-methyl-4-tetradecan-2-ylbenzene; trimethylazanium; dichloride Traditional Name: 1-methyl-4-(1-methyltridecyl)benzene; trimethylammonium; dichloride Formula: C27H56Cl2N2 MolecularWeight: 479.65294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)C1=CC=C(C=C1)C.C[NH+](C)C.C[NH+](C)C.[Cl-].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC(C)C1=CC=C(C=C1)C.C[NH+](C)C.C[NH+](C)C.[Cl-].[Cl-]

InChI

InChI=1S/C21H36.2C3H9N.2ClH/c1-4-5-6-7-8-9-10-11-12-13-14-20(3)21-17-15-19(2)16-18-21;2*1-4(2)3;;/h15-18,20H,4-14H2,1-3H3;2*1-3H3;2*1H