6-[(2-ethyl-2,7-dimethyl-3H-1-benzofuran-4-yl)carbonyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(2-ethyl-2,7-dimethyl-3H-1-benzofuran-4-yl)carbonyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-(2-ethyl-2,7-dimethyl-3H-benzofuran-4-carbonyl)cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(2-ethyl-2,7-dimethyl-3H-benzofuran-4-yl)-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-(2-ethyl-2,7-dimethyl-3H-1-benzofuran-4-carbonyl)cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-(2-ethyl-2,7-dimethyl-coumaran-4-carbonyl)cyclohex-3-ene-1-carboxylic acid Formula: C20H24O4 MolecularWeight: 328.40216

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=C(C=CC(=C2O1)C)C(=O)C3CC=CCC3C(=O)O)C

Isomeric SMILES

CCC1(CC2=C(C=CC(=C2O1)C)C(=O)C3CC=CCC3C(=O)O)C

InChI

InChI=1S/C20H24O4/c1-4-20(3)11-16-14(10-9-12(2)18(16)24-20)17(21)13-7-5-6-8-15(13)19(22)23/h5-6,9-10,13,15H,4,7-8,11H2,1-3H3,(H,22,23)