2-(2-methylphenyl)tetradecan-2-ylazanium bromide

Systemtic Name: 2-(2-methylphenyl)tetradecan-2-ylazanium bromide Openeye Name: [1-methyl-1-(o-tolyl)tridecyl]ammonium bromide CAS Name: 2-(2-methylphenyl)tetradecan-2-ylammonium bromide IUPAC Name: 2-(2-methylphenyl)tetradecan-2-ylazanium bromide Traditional Name: [1-methyl-1-(o-tolyl)tridecyl]ammonium bromide Formula: C21H38BrN MolecularWeight: 384.43712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)(C1=CC=CC=C1C)[NH3+].[Br-]

Isomeric SMILES

CCCCCCCCCCCCC(C)(C1=CC=CC=C1C)[NH3+].[Br-]

InChI

InChI=1S/C21H37N.BrH/c1-4-5-6-7-8-9-10-11-12-15-18-21(3,22)20-17-14-13-16-19(20)2;/h13-14,16-17H,4-12,15,18,22H2,1-3H3;1H