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3-(3-butyl-4-oxidanyl-phenyl)heptanoic acid

3-(3-butyl-4-oxidanyl-phenyl)heptanoic acid

Systemtic Name:3-(3-butyl-4-oxidanyl-phenyl)heptanoic acid
Openeye Name:3-(3-butyl-4-hydroxy-phenyl)heptanoic acid
CAS Name:3-(3-butyl-4-hydroxyphenyl)heptanoic acid
IUPAC Name:3-(3-butyl-4-hydroxyphenyl)heptanoic acid
Traditional Name:3-(3-butyl-4-hydroxy-phenyl)enanthic acid
Formula: C17H26O3
MolecularWeight: 278.38654
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C(CCCC)CC(=O)O)O


Isomeric SMILES

CCCCC1=C(C=CC(=C1)C(CCCC)CC(=O)O)O


InChI

InChI=1S/C17H26O3/c1-3-5-7-13(12-17(19)20)14-9-10-16(18)15(11-14)8-6-4-2/h9-11,13,18H,3-8,12H2,1-2H3,(H,19,20)


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