(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl (E)-3-(5-bromo-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-furanyl)-2-propenoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl (E)-3-(5-bromofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-furyl)acrylic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H19BrO5 MolecularWeight: 431.27656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C=CC3=CC=C(O3)Br)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)/C=C/C3=CC=C(O3)Br)C(C)C

InChI

InChI=1S/C21H19BrO5/c1-12(2)16-10-17-14(9-21(24)27-18(17)8-13(16)3)11-25-20(23)7-5-15-4-6-19(22)26-15/h4-10,12H,11H2,1-3H3/b7-5+