dimethyl-octadecyl-(1-phenylpropyl)azanium

Systemtic Name: dimethyl-octadecyl-(1-phenylpropyl)azanium Openeye Name: dimethyl-octadecyl-(1-phenylpropyl)ammonium CAS Name: dimethyl-octadecyl-(1-phenylpropyl)ammonium IUPAC Name: dimethyl-octadecyl-(1-phenylpropyl)azanium Traditional Name: dimethyl-(1-phenylpropyl)-stearyl-ammonium Formula: C29H54N+ MolecularWeight: 416.74576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)C(CC)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)C(CC)C1=CC=CC=C1

InChI

InChI=1S/C29H54N/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-30(3,4)29(6-2)28-25-22-21-23-26-28/h21-23,25-26,29H,5-20,24,27H2,1-4H3/q+1