2-[(E)-3-(4-acetyloxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)prop-1-enyl]-3-methyl-benzoate

Systemtic Name: 2-[(E)-3-(4-acetyloxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)prop-1-enyl]-3-methyl-benzoate Openeye Name: 2-[(E)-3-(4-acetoxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)prop-1-enyl]-3-methyl-benzoate CAS Name: 2-[(E)-3-(4-acetyloxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)prop-1-enyl]-3-methylbenzoate IUPAC Name: 2-[(E)-3-(4-acetyloxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)prop-1-enyl]-3-methylbenzoate Traditional Name: 2-[(E)-3-(4-acetoxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)prop-1-enyl]-3-methyl-benzoate Formula: C23H21O7- MolecularWeight: 409.40864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C=CCC2=C(C3=C(COC3=O)C(=C2OC)C)OC(=O)C)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1/C=C/CC2=C(C3=C(COC3=O)C(=C2OC)C)OC(=O)C)C(=O)[O-]

InChI

InChI=1S/C23H22O7/c1-12-7-5-9-16(22(25)26)15(12)8-6-10-17-20(28-4)13(2)18-11-29-23(27)19(18)21(17)30-14(3)24/h5-9H,10-11H2,1-4H3,(H,25,26)/p-1/b8-6+