2-cyano-3-(2,3-dihydro-1-benzofuran-5-yl)propanoic acid

Systemtic Name: 2-cyano-3-(2,3-dihydro-1-benzofuran-5-yl)propanoic acid Openeye Name: 2-cyano-3-(2,3-dihydrobenzofuran-5-yl)propanoic acid CAS Name: 2-cyano-3-(2,3-dihydrobenzofuran-5-yl)propanoic acid IUPAC Name: 2-cyano-3-(2,3-dihydro-1-benzofuran-5-yl)propanoic acid Traditional Name: 3-coumaran-5-yl-2-cyano-propionic acid Formula: C12H11NO3 MolecularWeight: 217.22064

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CC(C#N)C(=O)O

Isomeric SMILES

C1COC2=C1C=C(C=C2)CC(C#N)C(=O)O

InChI

InChI=1S/C12H11NO3/c13-7-10(12(14)15)6-8-1-2-11-9(5-8)3-4-16-11/h1-2,5,10H,3-4,6H2,(H,14,15)