7a-methyl-3-methylidene-2-oxidanylidene-3a,4,6,7-tetrahydro-1-benzofuran-5,5-dicarboxylic acid

Systemtic Name: 7a-methyl-3-methylidene-2-oxidanylidene-3a,4,6,7-tetrahydro-1-benzofuran-5,5-dicarboxylic acid Openeye Name: 7a-methyl-3-methylene-2-oxo-3a,4,6,7-tetrahydrobenzofuran-5,5-dicarboxylic acid CAS Name: 7a-methyl-3-methylene-2-oxo-3a,4,6,7-tetrahydrobenzofuran-5,5-dicarboxylic acid IUPAC Name: 7a-methyl-3-methylidene-2-oxo-3a,4,6,7-tetrahydro-1-benzofuran-5,5-dicarboxylic acid Traditional Name: 2-keto-7a-methyl-3-methylene-3a,4,6,7-tetrahydrobenzofuran-5,5-dicarboxylic acid Formula: C12H14O6 MolecularWeight: 254.23596

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(CC1C(=C)C(=O)O2)(C(=O)O)C(=O)O

Isomeric SMILES

CC12CCC(CC1C(=C)C(=O)O2)(C(=O)O)C(=O)O

InChI

InChI=1S/C12H14O6/c1-6-7-5-12(9(14)15,10(16)17)4-3-11(7,2)18-8(6)13/h7H,1,3-5H2,2H3,(H,14,15)(H,16,17)