(Z)-2-(1-ethylcyclohexyl)-4-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)but-2-enoic acid

Systemtic Name: (Z)-2-(1-ethylcyclohexyl)-4-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)but-2-enoic acid Openeye Name: (Z)-2-(1-ethylcyclohexyl)-4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)but-2-enoic acid CAS Name: (Z)-2-(1-ethylcyclohexyl)-4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-2-butenoic acid IUPAC Name: (Z)-2-(1-ethylcyclohexyl)-4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)but-2-enoic acid Traditional Name: (Z)-2-(1-ethylcyclohexyl)-4-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)but-2-enoic acid Formula: C22H28O6 MolecularWeight: 388.45412

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCCC1)C(=CCC2=C(C3=C(COC3=O)C(=C2OC)C)O)C(=O)O

Isomeric SMILES

CCC1(CCCCC1)/C(=C/CC2=C(C3=C(COC3=O)C(=C2OC)C)O)/C(=O)O

InChI

InChI=1S/C22H28O6/c1-4-22(10-6-5-7-11-22)16(20(24)25)9-8-14-18(23)17-15(12-28-21(17)26)13(2)19(14)27-3/h9,23H,4-8,10-12H2,1-3H3,(H,24,25)/b16-9+