2-(3,6-dimethyl-2H-1-benzofuran-3-yl)ethanoic acid

Systemtic Name: 2-(3,6-dimethyl-2H-1-benzofuran-3-yl)ethanoic acid Openeye Name: 2-(3,6-dimethyl-2H-benzofuran-3-yl)acetic acid CAS Name: 2-(3,6-dimethyl-2H-benzofuran-3-yl)acetic acid IUPAC Name: 2-(3,6-dimethyl-2H-1-benzofuran-3-yl)acetic acid Traditional Name: 2-(3,6-dimethylcoumaran-3-yl)acetic acid Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(CO2)(C)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)C(CO2)(C)CC(=O)O

InChI

InChI=1S/C12H14O3/c1-8-3-4-9-10(5-8)15-7-12(9,2)6-11(13)14/h3-5H,6-7H2,1-2H3,(H,13,14)