2-methyl-5-pentyl-furan-3-carboxylic acid

Systemtic Name: 2-methyl-5-pentyl-furan-3-carboxylic acid Openeye Name: 2-methyl-5-pentyl-furan-3-carboxylic acid CAS Name: 2-methyl-5-pentyl-3-furancarboxylic acid IUPAC Name: 2-methyl-5-pentylfuran-3-carboxylic acid Traditional Name: 5-amyl-2-methyl-3-furoic acid Formula: C11H16O3 MolecularWeight: 196.24294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(O1)C)C(=O)O

Isomeric SMILES

CCCCCC1=CC(=C(O1)C)C(=O)O

InChI

InChI=1S/C11H16O3/c1-3-4-5-6-9-7-10(11(12)13)8(2)14-9/h7H,3-6H2,1-2H3,(H,12,13)