(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-propenoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)acrylic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C20H13BrO6 MolecularWeight: 429.21762

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C20H13BrO6/c21-14-3-4-15-13(8-20(23)27-17(15)9-14)10-24-19(22)6-2-12-1-5-16-18(7-12)26-11-25-16/h1-9H,10-11H2/b6-2+