[4-[2-(2,4-dinitrophenyl)ethenyl]-2-methoxy-phenyl] 2-bromanyl-3,4,5-trimethoxy-benzoate

Systemtic Name: [4-[2-(2,4-dinitrophenyl)ethenyl]-2-methoxy-phenyl] 2-bromanyl-3,4,5-trimethoxy-benzoate Openeye Name: [4-[2-(2,4-dinitrophenyl)vinyl]-2-methoxy-phenyl] 2-bromo-3,4,5-trimethoxy-benzoate CAS Name: 2-bromo-3,4,5-trimethoxybenzoic acid [4-[2-(2,4-dinitrophenyl)ethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-(2,4-dinitrophenyl)ethenyl]-2-methoxyphenyl] 2-bromo-3,4,5-trimethoxybenzoate Traditional Name: 2-bromo-3,4,5-trimethoxy-benzoic acid [4-[2-(2,4-dinitrophenyl)vinyl]-2-methoxy-phenyl] ester Formula: C25H21BrN2O10 MolecularWeight: 589.34564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C3=CC(=C(C(=C3Br)OC)OC)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C=CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C3=CC(=C(C(=C3Br)OC)OC)OC

InChI

InChI=1S/C25H21BrN2O10/c1-34-20-11-14(5-7-15-8-9-16(27(30)31)12-18(15)28(32)33)6-10-19(20)38-25(29)17-13-21(35-2)23(36-3)24(37-4)22(17)26/h5-13H,1-4H3