(7E)-3-oxidanylidene-7-[(4-propan-2-ylphenyl)methylidene]-1,7a-dihydro-2-benzofuran-5-carboxylic acid

Systemtic Name: (7E)-3-oxidanylidene-7-[(4-propan-2-ylphenyl)methylidene]-1,7a-dihydro-2-benzofuran-5-carboxylic acid Openeye Name: (7E)-7-[(4-isopropylphenyl)methylene]-3-oxo-1,7a-dihydroisobenzofuran-5-carboxylic acid CAS Name: (7E)-3-oxo-7-[(4-propan-2-ylphenyl)methylidene]-1,7a-dihydroisobenzofuran-5-carboxylic acid IUPAC Name: (7E)-3-oxo-7-[(4-propan-2-ylphenyl)methylidene]-1,7a-dihydro-2-benzofuran-5-carboxylic acid Traditional Name: (7E)-7-(4-isopropylbenzylidene)-3-keto-1,7a-dihydroisobenzofuran-5-carboxylic acid Formula: C19H18O4 MolecularWeight: 310.34382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C2C=C(C=C3C2COC3=O)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/2\C=C(C=C3C2COC3=O)C(=O)O

InChI

InChI=1S/C19H18O4/c1-11(2)13-5-3-12(4-6-13)7-14-8-15(18(20)21)9-16-17(14)10-23-19(16)22/h3-9,11,17H,10H2,1-2H3,(H,20,21)/b14-7+