[2-(furan-2-yl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] 3-bromanylbenzoate

Systemtic Name: [2-(furan-2-yl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] 3-bromanylbenzoate Openeye Name: [2-(2-furyl)-6,8-dimethyl-4-oxo-chromen-3-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-(2-furanyl)-6,8-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(furan-2-yl)-6,8-dimethyl-4-oxochromen-3-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-(2-furyl)-4-keto-6,8-dimethyl-chromen-3-yl] ester Formula: C22H15BrO5 MolecularWeight: 439.2555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OC(=O)C4=CC(=CC=C4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OC(=O)C4=CC(=CC=C4)Br)C

InChI

InChI=1S/C22H15BrO5/c1-12-9-13(2)19-16(10-12)18(24)21(20(27-19)17-7-4-8-26-17)28-22(25)14-5-3-6-15(23)11-14/h3-11H,1-2H3