3-ethyl-2,2-dimethyl-3H-1-benzofuran-4-carboxylic acid

Systemtic Name: 3-ethyl-2,2-dimethyl-3H-1-benzofuran-4-carboxylic acid Openeye Name: 3-ethyl-2,2-dimethyl-3H-benzofuran-4-carboxylic acid CAS Name: 3-ethyl-2,2-dimethyl-3H-benzofuran-4-carboxylic acid IUPAC Name: 3-ethyl-2,2-dimethyl-3H-1-benzofuran-4-carboxylic acid Traditional Name: 3-ethyl-2,2-dimethyl-coumaran-4-carboxylic acid Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(C=CC=C2OC1(C)C)C(=O)O

Isomeric SMILES

CCC1C2=C(C=CC=C2OC1(C)C)C(=O)O

InChI

InChI=1S/C13H16O3/c1-4-9-11-8(12(14)15)6-5-7-10(11)16-13(9,2)3/h5-7,9H,4H2,1-3H3,(H,14,15)