[4-[(3-bromophenyl)iminomethyl]-2-methoxy-phenyl] 2-(2,4-dinitrophenyl)ethanoate

Systemtic Name: [4-[(3-bromophenyl)iminomethyl]-2-methoxy-phenyl] 2-(2,4-dinitrophenyl)ethanoate Openeye Name: [4-[(3-bromophenyl)iminomethyl]-2-methoxy-phenyl] 2-(2,4-dinitrophenyl)acetate CAS Name: 2-(2,4-dinitrophenyl)acetic acid [4-[(3-bromophenyl)iminomethyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(3-bromophenyl)iminomethyl]-2-methoxyphenyl] 2-(2,4-dinitrophenyl)acetate Traditional Name: 2-(2,4-dinitrophenyl)acetic acid [4-[(3-bromophenyl)iminomethyl]-2-methoxy-phenyl] ester Formula: C22H16BrN3O7 MolecularWeight: 514.28234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NC2=CC(=CC=C2)Br)OC(=O)CC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C=NC2=CC(=CC=C2)Br)OC(=O)CC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H16BrN3O7/c1-32-21-9-14(13-24-17-4-2-3-16(23)11-17)5-8-20(21)33-22(27)10-15-6-7-18(25(28)29)12-19(15)26(30)31/h2-9,11-13H,10H2,1H3