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4-(dimethylamino)-2-(2-ethylhexyl)benzoic acid

4-(dimethylamino)-2-(2-ethylhexyl)benzoic acid

Systemtic Name:4-(dimethylamino)-2-(2-ethylhexyl)benzoic acid
Openeye Name:4-(dimethylamino)-2-(2-ethylhexyl)benzoic acid
CAS Name:4-(dimethylamino)-2-(2-ethylhexyl)benzoic acid
IUPAC Name:4-(dimethylamino)-2-(2-ethylhexyl)benzoic acid
Traditional Name:4-(dimethylamino)-2-(2-ethylhexyl)benzoic acid
Formula: C17H27NO2
MolecularWeight: 277.40178
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1=C(C=CC(=C1)N(C)C)C(=O)O


Isomeric SMILES

CCCCC(CC)CC1=C(C=CC(=C1)N(C)C)C(=O)O


InChI

InChI=1S/C17H27NO2/c1-5-7-8-13(6-2)11-14-12-15(18(3)4)9-10-16(14)17(19)20/h9-10,12-13H,5-8,11H2,1-4H3,(H,19,20)


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