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dihexadecyl(dimethyl)azanium; quinoline-2-carboxylate

dihexadecyl(dimethyl)azanium; quinoline-2-carboxylate

Systemtic Name:dihexadecyl(dimethyl)azanium; quinoline-2-carboxylate
Openeye Name:dihexadecyl(dimethyl)ammonium; quinoline-2-carboxylate
CAS Name:dihexadecyl(dimethyl)ammonium; 2-quinolinecarboxylate
IUPAC Name:dihexadecyl(dimethyl)azanium; quinoline-2-carboxylate
Traditional Name:dicetyl(dimethyl)ammonium; quinaldate
Formula: C44H78N2O2
MolecularWeight: 667.10232
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCC.C1=CC=C2C(=C1)C=CC(=N2)C(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCC.C1=CC=C2C(=C1)C=CC(=N2)C(=O)[O-]


InChI

InChI=1S/C34H72N.C10H7NO2/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(3,4)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h5-34H2,1-4H3;1-6H,(H,12,13)/q+1;/p-1


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