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2-[(2-tert-butylphenyl)methyl]hexanoic acid

2-[(2-tert-butylphenyl)methyl]hexanoic acid

Systemtic Name:2-[(2-tert-butylphenyl)methyl]hexanoic acid
Openeye Name:2-[(2-tert-butylphenyl)methyl]hexanoic acid
CAS Name:2-[(2-tert-butylphenyl)methyl]hexanoic acid
IUPAC Name:2-[(2-tert-butylphenyl)methyl]hexanoic acid
Traditional Name:2-(2-tert-butylbenzyl)hexanoic acid
Formula: C17H26O2
MolecularWeight: 262.38714
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=CC=C1C(C)(C)C)C(=O)O


Isomeric SMILES

CCCCC(CC1=CC=CC=C1C(C)(C)C)C(=O)O


InChI

InChI=1S/C17H26O2/c1-5-6-9-14(16(18)19)12-13-10-7-8-11-15(13)17(2,3)4/h7-8,10-11,14H,5-6,9,12H2,1-4H3,(H,18,19)


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