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5-butan-2-yl-3-(chloromethyl)-2-oxidanyl-benzoic acid

5-butan-2-yl-3-(chloromethyl)-2-oxidanyl-benzoic acid

Systemtic Name:5-butan-2-yl-3-(chloromethyl)-2-oxidanyl-benzoic acid
Openeye Name:3-(chloromethyl)-2-hydroxy-5-sec-butyl-benzoic acid
CAS Name:5-butan-2-yl-3-(chloromethyl)-2-hydroxybenzoic acid
IUPAC Name:5-butan-2-yl-3-(chloromethyl)-2-hydroxybenzoic acid
Traditional Name:3-(chloromethyl)-2-hydroxy-5-sec-butyl-benzoic acid
Formula: C12H15ClO3
MolecularWeight: 242.6987
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C(=C1)C(=O)O)O)CCl


Isomeric SMILES

CCC(C)C1=CC(=C(C(=C1)C(=O)O)O)CCl


InChI

InChI=1S/C12H15ClO3/c1-3-7(2)8-4-9(6-13)11(14)10(5-8)12(15)16/h4-5,7,14H,3,6H2,1-2H3,(H,15,16)


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