5-[[4-(1-oxidanylbutyl)phenoxy]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[4-(1-oxidanylbutyl)phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-(1-hydroxybutyl)phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-(1-hydroxybutyl)phenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-(1-hydroxybutyl)phenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-(1-hydroxybutyl)phenoxy]methyl]-2-furoic acid Formula: C16H18O5 MolecularWeight: 290.31112

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)O)O

Isomeric SMILES

CCCC(C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)O)O

InChI

InChI=1S/C16H18O5/c1-2-3-14(17)11-4-6-12(7-5-11)20-10-13-8-9-15(21-13)16(18)19/h4-9,14,17H,2-3,10H2,1H3,(H,18,19)