2-(octan-2-yloxymethyl)furan-3-carboxylic acid

Systemtic Name: 2-(octan-2-yloxymethyl)furan-3-carboxylic acid Openeye Name: 2-(1-methylheptoxymethyl)furan-3-carboxylic acid CAS Name: 2-(octan-2-yloxymethyl)-3-furancarboxylic acid IUPAC Name: 2-(octan-2-yloxymethyl)furan-3-carboxylic acid Traditional Name: 2-(1-methylheptoxymethyl)-3-furoic acid Formula: C14H22O4 MolecularWeight: 254.32208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OCC1=C(C=CO1)C(=O)O

Isomeric SMILES

CCCCCCC(C)OCC1=C(C=CO1)C(=O)O

InChI

InChI=1S/C14H22O4/c1-3-4-5-6-7-11(2)18-10-13-12(14(15)16)8-9-17-13/h8-9,11H,3-7,10H2,1-2H3,(H,15,16)