[1-(4-ethoxyphenyl)-3-methyl-pentan-3-yl]-octyl-dipropyl-azanium

Systemtic Name: [1-(4-ethoxyphenyl)-3-methyl-pentan-3-yl]-octyl-dipropyl-azanium Openeye Name: [3-(4-ethoxyphenyl)-1-ethyl-1-methyl-propyl]-octyl-dipropyl-ammonium CAS Name: [1-(4-ethoxyphenyl)-3-methylpentan-3-yl]-octyl-dipropylammonium IUPAC Name: [1-(4-ethoxyphenyl)-3-methylpentan-3-yl]-octyl-dipropylazanium Traditional Name: (1-ethyl-1-methyl-3-p-phenetyl-propyl)-octyl-dipropyl-ammonium Formula: C28H52NO+ MolecularWeight: 418.71858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](CCC)(CCC)C(C)(CC)CCC1=CC=C(C=C1)OCC

Isomeric SMILES

CCCCCCCC[N+](CCC)(CCC)C(C)(CC)CCC1=CC=C(C=C1)OCC

InChI

InChI=1S/C28H52NO/c1-7-12-13-14-15-16-25-29(23-8-2,24-9-3)28(6,10-4)22-21-26-17-19-27(20-18-26)30-11-5/h17-20H,7-16,21-25H2,1-6H3/q+1