[6-ethyl-2-(furan-2-yl)-4-oxidanylidene-chromen-3-yl] 3-bromanylbenzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC(=CC=C3)Br)C4=CC=CO4

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC(=CC=C3)Br)C4=CC=CO4

InChI

InChI=1S/C22H15BrO5/c1-2-13-8-9-17-16(11-13)19(24)21(20(27-17)18-7-4-10-26-18)28-22(25)14-5-3-6-15(23)12-14/h3-12H,2H2,1H3