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5-heptylfuran-3-carboxylic acid

5-heptylfuran-3-carboxylic acid

Systemtic Name:5-heptylfuran-3-carboxylic acid
Openeye Name:5-heptylfuran-3-carboxylic acid
CAS Name:5-heptyl-3-furancarboxylic acid
IUPAC Name:5-heptylfuran-3-carboxylic acid
Traditional Name:5-heptyl-3-furoic acid
Formula: C12H18O3
MolecularWeight: 210.26952
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=CO1)C(=O)O


Isomeric SMILES

CCCCCCCC1=CC(=CO1)C(=O)O


InChI

InChI=1S/C12H18O3/c1-2-3-4-5-6-7-11-8-10(9-15-11)12(13)14/h8-9H,2-7H2,1H3,(H,13,14)


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