1-hexadecylpyridin-1-ium-4-amine bromide

Systemtic Name: 1-hexadecylpyridin-1-ium-4-amine bromide Openeye Name: 1-hexadecylpyridin-1-ium-4-amine bromide CAS Name: 1-hexadecyl-4-pyridin-1-iumamine bromide IUPAC Name: 1-hexadecylpyridin-1-ium-4-amine bromide Traditional Name: (1-cetylpyridin-1-ium-4-yl)amine bromide Formula: C21H39BrN2 MolecularWeight: 399.45176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)N.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)N.[Br-]

InChI

InChI=1S/C21H38N2.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-23-19-16-21(22)17-20-23;/h16-17,19-20,22H,2-15,18H2,1H3;1H