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2-bromanyl-6-(2-methylheptan-2-yloxycarbonyl)benzoic acid

2-bromanyl-6-(2-methylheptan-2-yloxycarbonyl)benzoic acid

Systemtic Name:2-bromanyl-6-(2-methylheptan-2-yloxycarbonyl)benzoic acid
Openeye Name:2-bromo-6-(1,1-dimethylhexoxycarbonyl)benzoic acid
CAS Name:2-bromo-6-[2-methylheptan-2-yloxy(oxo)methyl]benzoic acid
IUPAC Name:2-bromo-6-(2-methylheptan-2-yloxycarbonyl)benzoic acid
Traditional Name:2-bromo-6-(1,1-dimethylhexoxycarbonyl)benzoic acid
Formula: C16H21BrO4
MolecularWeight: 357.23954
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)OC(=O)C1=C(C(=CC=C1)Br)C(=O)O


Isomeric SMILES

CCCCCC(C)(C)OC(=O)C1=C(C(=CC=C1)Br)C(=O)O


InChI

InChI=1S/C16H21BrO4/c1-4-5-6-10-16(2,3)21-15(20)11-8-7-9-12(17)13(11)14(18)19/h7-9H,4-6,10H2,1-3H3,(H,18,19)


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