[6-chloranyl-2-(furan-2-yl)-7-methyl-4-oxidanylidene-chromen-3-yl] 2-bromanylbenzoate

Systemtic Name: [6-chloranyl-2-(furan-2-yl)-7-methyl-4-oxidanylidene-chromen-3-yl] 2-bromanylbenzoate Openeye Name: [6-chloro-2-(2-furyl)-7-methyl-4-oxo-chromen-3-yl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [6-chloro-2-(2-furanyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(furan-2-yl)-7-methyl-4-oxochromen-3-yl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [6-chloro-2-(2-furyl)-4-keto-7-methyl-chromen-3-yl] ester Formula: C21H12BrClO5 MolecularWeight: 459.67398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC=CC=C3Br)C4=CC=CO4)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC=CC=C3Br)C4=CC=CO4)Cl

InChI

InChI=1S/C21H12BrClO5/c1-11-9-17-13(10-15(11)23)18(24)20(19(27-17)16-7-4-8-26-16)28-21(25)12-5-2-3-6-14(12)22/h2-10H,1H3