[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-bromanylbenzoate

Systemtic Name: [3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-bromanylbenzoate Openeye Name: [3-(3-methylphenoxy)-4-oxo-chromen-7-yl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [3-(3-methylphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(3-methylphenoxy)-4-oxochromen-7-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-keto-3-(3-methylphenoxy)chromen-7-yl] ester Formula: C23H15BrO5 MolecularWeight: 451.2662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=CC=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H15BrO5/c1-14-3-2-4-17(11-14)28-21-13-27-20-12-18(9-10-19(20)22(21)25)29-23(26)15-5-7-16(24)8-6-15/h2-13H,1H3