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1-docosylquinolin-1-ium

1-docosylquinolin-1-ium

Systemtic Name:1-docosylquinolin-1-ium
Openeye Name:1-docosylquinolin-1-ium
CAS Name:1-docosylquinolin-1-ium
IUPAC Name:1-docosylquinolin-1-ium
Traditional Name:1-behenylquinolin-1-ium
Formula: C31H52N+
MolecularWeight: 438.75128
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC[N+]1=CC=CC2=CC=CC=C21


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC[N+]1=CC=CC2=CC=CC=C21


InChI

InChI=1S/C31H52N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-28-32-29-24-26-30-25-21-22-27-31(30)32/h21-22,24-27,29H,2-20,23,28H2,1H3/q+1


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