2-[(Z)-4-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)but-2-en-2-yl]benzoic acid

Systemtic Name: 2-[(Z)-4-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)but-2-en-2-yl]benzoic acid Openeye Name: 2-[(Z)-3-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-1-methyl-prop-1-enyl]benzoic acid CAS Name: 2-[(Z)-4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)but-2-en-2-yl]benzoic acid IUPAC Name: 2-[(Z)-4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)but-2-en-2-yl]benzoic acid Traditional Name: 2-[(Z)-3-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-1-methyl-prop-1-enyl]benzoic acid Formula: C21H20O6 MolecularWeight: 368.3799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)C3=CC=CC=C3C(=O)O)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(/C)\C3=CC=CC=C3C(=O)O)OC

InChI

InChI=1S/C21H20O6/c1-11(13-6-4-5-7-14(13)20(23)24)8-9-15-18(22)17-16(10-27-21(17)25)12(2)19(15)26-3/h4-8,22H,9-10H2,1-3H3,(H,23,24)/b11-8-