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4-[dodecyl(dimethyl)azaniumyl]benzoate

4-[dodecyl(dimethyl)azaniumyl]benzoate

Systemtic Name:4-[dodecyl(dimethyl)azaniumyl]benzoate
Openeye Name:4-[dodecyl(dimethyl)ammonio]benzoate
CAS Name:4-[dodecyl(dimethyl)ammonio]benzoate
IUPAC Name:4-[dodecyl(dimethyl)azaniumyl]benzoate
Traditional Name:4-[lauryl(dimethyl)ammonio]benzoate
Formula: C21H35NO2
MolecularWeight: 333.5081
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)C1=CC=C(C=C1)C(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)C1=CC=C(C=C1)C(=O)[O-]


InChI

InChI=1S/C21H35NO2/c1-4-5-6-7-8-9-10-11-12-13-18-22(2,3)20-16-14-19(15-17-20)21(23)24/h14-17H,4-13,18H2,1-3H3


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