5-[(E,5S)-3,5-dimethyl-6-oxidanyl-6-oxidanylidene-hex-2-enyl]-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-4-carboxylic acid

Systemtic Name: 5-[(E,5S)-3,5-dimethyl-6-oxidanyl-6-oxidanylidene-hex-2-enyl]-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-4-carboxylic acid Openeye Name: 5-[(E,5S)-6-hydroxy-3,5-dimethyl-6-oxo-hex-2-enyl]-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-4-carboxylic acid CAS Name: 5-[(E,5S)-6-hydroxy-3,5-dimethyl-6-oxohex-2-enyl]-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-4-carboxylic acid IUPAC Name: 5-[(E,5S)-6-hydroxy-3,5-dimethyl-6-oxohex-2-enyl]-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-4-carboxylic acid Traditional Name: 5-[(E,5S)-6-hydroxy-6-keto-3,5-dimethyl-hex-2-enyl]-3-keto-6-methoxy-7-methyl-phthalan-4-carboxylic acid Formula: C19H22O7 MolecularWeight: 362.37378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CC(C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\C)/C[C@H](C)C(=O)O)C(=O)O

InChI

InChI=1S/C19H22O7/c1-9(7-10(2)17(20)21)5-6-12-14(18(22)23)15-13(8-26-19(15)24)11(3)16(12)25-4/h5,10H,6-8H2,1-4H3,(H,20,21)(H,22,23)/b9-5+/t10-/m0/s1