trimethyl(4-pyren-1-ylbutyl)azanium bromide

Systemtic Name: trimethyl(4-pyren-1-ylbutyl)azanium bromide Openeye Name: trimethyl(4-pyren-1-ylbutyl)ammonium bromide CAS Name: trimethyl-[4-(1-pyrenyl)butyl]ammonium bromide IUPAC Name: trimethyl(4-pyren-1-ylbutyl)azanium bromide Traditional Name: trimethyl(4-pyren-1-ylbutyl)ammonium bromide Formula: C23H26BrN MolecularWeight: 396.36324

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1.[Br-]

Isomeric SMILES

C[N+](C)(C)CCCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1.[Br-]

InChI

InChI=1S/C23H26N.BrH/c1-24(2,3)16-5-4-7-17-10-11-20-13-12-18-8-6-9-19-14-15-21(17)23(20)22(18)19;/h6,8-15H,4-5,7,16H2,1-3H3;1H/q+1;/p-1