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2-ethylhexanoate; ethyl-[(4-methoxyphenyl)methyl]-dimethyl-azanium

2-ethylhexanoate; ethyl-[(4-methoxyphenyl)methyl]-dimethyl-azanium

Systemtic Name:2-ethylhexanoate; ethyl-[(4-methoxyphenyl)methyl]-dimethyl-azanium
Openeye Name:2-ethylhexanoate; ethyl-[(4-methoxyphenyl)methyl]-dimethyl-ammonium
CAS Name:2-ethylhexanoate; ethyl-[(4-methoxyphenyl)methyl]-dimethylammonium
IUPAC Name:2-ethylhexanoate; ethyl-[(4-methoxyphenyl)methyl]-dimethylazanium
Traditional Name:ethyl-dimethyl-p-anisyl-ammonium; 2-ethylhexanoate
Formula: C20H35NO3
MolecularWeight: 337.4968
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)[O-].CC[N+](C)(C)CC1=CC=C(C=C1)OC


Isomeric SMILES

CCCCC(CC)C(=O)[O-].CC[N+](C)(C)CC1=CC=C(C=C1)OC


InChI

InChI=1S/C12H20NO.C8H16O2/c1-5-13(2,3)10-11-6-8-12(14-4)9-7-11;1-3-5-6-7(4-2)8(9)10/h6-9H,5,10H2,1-4H3;7H,3-6H2,1-2H3,(H,9,10)/q+1;/p-1


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