[2-(3-bromanyl-4-methoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 3-nitrobenzoate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 3-nitrobenzoate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-4-oxo-chromen-3-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(3-bromo-4-methoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3-bromo-4-methoxyphenyl)-4-oxochromen-3-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(3-bromo-4-methoxy-phenyl)-4-keto-chromen-3-yl] ester Formula: C23H14BrNO7 MolecularWeight: 496.26376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C23H14BrNO7/c1-30-19-10-9-13(12-17(19)24)21-22(20(26)16-7-2-3-8-18(16)31-21)32-23(27)14-5-4-6-15(11-14)25(28)29/h2-12H,1H3