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

Systemtic Name: 6-[(7-methoxy-2,2-dimethyl-3H-1-benzofuran-4-yl)carbonyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-(7-methoxy-2,2-dimethyl-3H-benzofuran-4-carbonyl)cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(7-methoxy-2,2-dimethyl-3H-benzofuran-4-yl)-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-(7-methoxy-2,2-dimethyl-3H-1-benzofuran-4-carbonyl)cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-(7-methoxy-2,2-dimethyl-coumaran-4-carbonyl)cyclohex-3-ene-1-carboxylic acid Formula: C19H22O5 MolecularWeight: 330.37498

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2O1)OC)C(=O)C3CC=CCC3C(=O)O)C

Isomeric SMILES

CC1(CC2=C(C=CC(=C2O1)OC)C(=O)C3CC=CCC3C(=O)O)C

InChI

InChI=1S/C19H22O5/c1-19(2)10-14-12(8-9-15(23-3)17(14)24-19)16(20)11-6-4-5-7-13(11)18(21)22/h4-5,8-9,11,13H,6-7,10H2,1-3H3,(H,21,22)