2-[[4-(3-oxidanylidenebutyl)phenoxy]methyl]furan-3-carboxylic acid

Systemtic Name: 2-[[4-(3-oxidanylidenebutyl)phenoxy]methyl]furan-3-carboxylic acid Openeye Name: 2-[[4-(3-oxobutyl)phenoxy]methyl]furan-3-carboxylic acid CAS Name: 2-[[4-(3-oxobutyl)phenoxy]methyl]-3-furancarboxylic acid IUPAC Name: 2-[[4-(3-oxobutyl)phenoxy]methyl]furan-3-carboxylic acid Traditional Name: 2-[[4-(3-ketobutyl)phenoxy]methyl]-3-furoic acid Formula: C16H16O5 MolecularWeight: 288.29524

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OCC2=C(C=CO2)C(=O)O

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OCC2=C(C=CO2)C(=O)O

InChI

InChI=1S/C16H16O5/c1-11(17)2-3-12-4-6-13(7-5-12)21-10-15-14(16(18)19)8-9-20-15/h4-9H,2-3,10H2,1H3,(H,18,19)