(Z)-4-chloranyl-2-ethoxycarbonyl-6-(6-methoxy-7-methyl-4-methylsulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl)hex-4-enoic acid

Systemtic Name: (Z)-4-chloranyl-2-ethoxycarbonyl-6-(6-methoxy-7-methyl-4-methylsulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl)hex-4-enoic acid Openeye Name: (Z)-4-chloro-2-ethoxycarbonyl-6-(6-methoxy-7-methyl-4-methylsulfonyloxy-3-oxo-1H-isobenzofuran-5-yl)hex-4-enoic acid CAS Name: (Z)-4-chloro-2-ethoxycarbonyl-6-(6-methoxy-7-methyl-4-methylsulfonyloxy-3-oxo-1H-isobenzofuran-5-yl)-4-hexenoic acid IUPAC Name: (Z)-4-chloro-2-ethoxycarbonyl-6-(6-methoxy-7-methyl-4-methylsulfonyloxy-3-oxo-1H-2-benzofuran-5-yl)hex-4-enoic acid Traditional Name: (Z)-2-carbethoxy-4-chloro-6-(3-keto-6-methoxy-7-methyl-4-methylsulfonyloxy-phthalan-5-yl)hex-4-enoic acid Formula: C20H23ClO10S MolecularWeight: 490.90862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=CCC1=C(C2=C(COC2=O)C(=C1OC)C)OS(=O)(=O)C)Cl)C(=O)O

Isomeric SMILES

CCOC(=O)C(C/C(=C/CC1=C(C2=C(COC2=O)C(=C1OC)C)OS(=O)(=O)C)/Cl)C(=O)O

InChI

InChI=1S/C20H23ClO10S/c1-5-29-19(24)13(18(22)23)8-11(21)6-7-12-16(28-3)10(2)14-9-30-20(25)15(14)17(12)31-32(4,26)27/h6,13H,5,7-9H2,1-4H3,(H,22,23)/b11-6-