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di(nonadecan-2-yl)azanium ethanoate

di(nonadecan-2-yl)azanium ethanoate

Systemtic Name:di(nonadecan-2-yl)azanium ethanoate
Openeye Name:bis(1-methyloctadecyl)ammonium acetate
CAS Name:di(nonadecan-2-yl)ammonium acetate
IUPAC Name:di(nonadecan-2-yl)azanium acetate
Traditional Name:bis(1-methyloctadecyl)ammonium acetate
Formula: C40H83NO2
MolecularWeight: 610.09252
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(C)[NH2+]C(C)CCCCCCCCCCCCCCCCC.CC(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(C)[NH2+]C(C)CCCCCCCCCCCCCCCCC.CC(=O)[O-]


InChI

InChI=1S/C38H79N.C2H4O2/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37(3)39-38(4)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;1-2(3)4/h37-39H,5-36H2,1-4H3;1H3,(H,3,4)


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