5-[(E)-1-cyclohexyloxy-1-oxidanylidene-but-2-en-2-yl]-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-4-carboxylic acid

Systemtic Name: 5-[(E)-1-cyclohexyloxy-1-oxidanylidene-but-2-en-2-yl]-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-4-carboxylic acid Openeye Name: 5-[(E)-1-(cyclohexoxycarbonyl)prop-1-enyl]-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-4-carboxylic acid CAS Name: 5-[(E)-1-cyclohexyloxy-1-oxobut-2-en-2-yl]-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-4-carboxylic acid IUPAC Name: 5-[(E)-1-cyclohexyloxy-1-oxobut-2-en-2-yl]-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-4-carboxylic acid Traditional Name: 5-[(E)-1-(cyclohexoxycarbonyl)prop-1-enyl]-3-keto-6-methoxy-7-methyl-phthalan-4-carboxylic acid Formula: C21H24O7 MolecularWeight: 388.41106

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C1=C(C(=C2COC(=O)C2=C1C(=O)O)C)OC)C(=O)OC3CCCCC3

Isomeric SMILES

C/C=C(\C1=C(C(=C2COC(=O)C2=C1C(=O)O)C)OC)/C(=O)OC3CCCCC3

InChI

InChI=1S/C21H24O7/c1-4-13(20(24)28-12-8-6-5-7-9-12)15-17(19(22)23)16-14(10-27-21(16)25)11(2)18(15)26-3/h4,12H,5-10H2,1-3H3,(H,22,23)/b13-4+