(4-methylphenyl)-octadecyl-dipropyl-azanium

Systemtic Name: (4-methylphenyl)-octadecyl-dipropyl-azanium Openeye Name: octadecyl-dipropyl-(p-tolyl)ammonium CAS Name: (4-methylphenyl)-octadecyl-dipropylammonium IUPAC Name: (4-methylphenyl)-octadecyl-dipropylazanium Traditional Name: dipropyl-(p-tolyl)-stearyl-ammonium Formula: C31H58N+ MolecularWeight: 444.79892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H58N/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-29-32(27-6-2,28-7-3)31-25-23-30(4)24-26-31/h23-26H,5-22,27-29H2,1-4H3/q+1