(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate CAS Name: 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate Traditional Name: 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C21H15BrN2O6 MolecularWeight: 471.2576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)COC2=CC=C(C=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

CC1=NC(=NO1)COC2=CC=C(C=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C21H15BrN2O6/c1-12-23-19(24-30-12)11-27-16-5-2-13(3-6-16)21(26)28-10-14-8-20(25)29-18-9-15(22)4-7-17(14)18/h2-9H,10-11H2,1H3