2-pentyl-4H-1,3-benzodioxine-6-carboxylic acid

Systemtic Name: 2-pentyl-4H-1,3-benzodioxine-6-carboxylic acid Openeye Name: 2-pentyl-4H-1,3-benzodioxine-6-carboxylic acid CAS Name: 2-pentyl-4H-1,3-benzodioxin-6-carboxylic acid IUPAC Name: 2-pentyl-4H-1,3-benzodioxine-6-carboxylic acid Traditional Name: 2-amyl-4H-1,3-benzodioxin-6-carboxylic acid Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1OCC2=C(O1)C=CC(=C2)C(=O)O

Isomeric SMILES

CCCCCC1OCC2=C(O1)C=CC(=C2)C(=O)O

InChI

InChI=1S/C14H18O4/c1-2-3-4-5-13-17-9-11-8-10(14(15)16)6-7-12(11)18-13/h6-8,13H,2-5,9H2,1H3,(H,15,16)