5-[[4-(2-methylpentan-2-yl)phenoxy]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[4-(2-methylpentan-2-yl)phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-(1,1-dimethylbutyl)phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-(2-methylpentan-2-yl)phenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-(2-methylpentan-2-yl)phenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-(1,1-dimethylbutyl)phenoxy]methyl]-2-furoic acid Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22O4/c1-4-11-18(2,3)13-5-7-14(8-6-13)21-12-15-9-10-16(22-15)17(19)20/h5-10H,4,11-12H2,1-3H3,(H,19,20)