5-ethoxycarbonyl-3,4-dihydro-1H-isochromene-7-carboxylic acid

Systemtic Name: 5-ethoxycarbonyl-3,4-dihydro-1H-isochromene-7-carboxylic acid Openeye Name: 5-ethoxycarbonylisochromane-7-carboxylic acid CAS Name: 5-ethoxycarbonyl-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid IUPAC Name: 5-ethoxycarbonyl-3,4-dihydro-1H-isochromene-7-carboxylic acid Traditional Name: 5-carbethoxyisochroman-7-carboxylic acid Formula: C13H14O5 MolecularWeight: 250.24726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCOCC2=CC(=C1)C(=O)O

Isomeric SMILES

CCOC(=O)C1=C2CCOCC2=CC(=C1)C(=O)O

InChI

InChI=1S/C13H14O5/c1-2-18-13(16)11-6-8(12(14)15)5-9-7-17-4-3-10(9)11/h5-6H,2-4,7H2,1H3,(H,14,15)