[2-(3-bromanyl-4-methoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 2-chloranyl-4-nitro-benzoate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 2-chloranyl-4-nitro-benzoate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-4-oxo-chromen-3-yl] 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-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] 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid [2-(3-bromo-4-methoxy-phenyl)-4-keto-chromen-3-yl] ester Formula: C23H13BrClNO7 MolecularWeight: 530.70882

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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=C(C=C(C=C4)[N+](=O)[O-])Cl)Br

Isomeric SMILES

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

InChI

InChI=1S/C23H13BrClNO7/c1-31-19-9-6-12(10-16(19)24)21-22(20(27)15-4-2-3-5-18(15)32-21)33-23(28)14-8-7-13(26(29)30)11-17(14)25/h2-11H,1H3