5-[(2E)-2-[3-(carboxymethyl)oxan-4-ylidene]ethyl]-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-4-carboxylic acid

Systemtic Name: 5-[(2E)-2-[3-(carboxymethyl)oxan-4-ylidene]ethyl]-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-4-carboxylic acid Openeye Name: 5-[(2E)-2-[3-(carboxymethyl)tetrahydropyran-4-ylidene]ethyl]-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-4-carboxylic acid CAS Name: 5-[(2E)-2-[3-(carboxymethyl)-4-oxanylidene]ethyl]-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-4-carboxylic acid IUPAC Name: 5-[(2E)-2-[3-(carboxymethyl)oxan-4-ylidene]ethyl]-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-4-carboxylic acid Traditional Name: 5-[(2E)-2-[3-(carboxymethyl)tetrahydropyran-4-ylidene]ethyl]-3-keto-6-methoxy-7-methyl-phthalan-4-carboxylic acid Formula: C20H22O8 MolecularWeight: 390.38388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2COC(=O)C2=C(C(=C1OC)CC=C3CCOCC3CC(=O)O)C(=O)O

Isomeric SMILES

CC1=C2COC(=O)C2=C(C(=C1OC)C/C=C/3\CCOCC3CC(=O)O)C(=O)O

InChI

InChI=1S/C20H22O8/c1-10-14-9-28-20(25)17(14)16(19(23)24)13(18(10)26-2)4-3-11-5-6-27-8-12(11)7-15(21)22/h3,12H,4-9H2,1-2H3,(H,21,22)(H,23,24)/b11-3+