trimethyl-[2-(methylamino)-2-(4-octylphenyl)propyl]azanium

Systemtic Name: trimethyl-[2-(methylamino)-2-(4-octylphenyl)propyl]azanium Openeye Name: trimethyl-[2-(methylamino)-2-(4-octylphenyl)propyl]ammonium CAS Name: trimethyl-[2-(methylamino)-2-(4-octylphenyl)propyl]ammonium IUPAC Name: trimethyl-[2-(methylamino)-2-(4-octylphenyl)propyl]azanium Traditional Name: trimethyl-[2-(methylamino)-2-(4-octylphenyl)propyl]ammonium Formula: C21H39N2+ MolecularWeight: 319.54776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(C)(C[N+](C)(C)C)NC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(C)(C[N+](C)(C)C)NC

InChI

InChI=1S/C21H39N2/c1-7-8-9-10-11-12-13-19-14-16-20(17-15-19)21(2,22-3)18-23(4,5)6/h14-17,22H,7-13,18H2,1-6H3/q+1