[4-[(4-bromophenyl)iminomethyl]-2-methoxy-phenyl] 3-nitrobenzoate

Systemtic Name: [4-[(4-bromophenyl)iminomethyl]-2-methoxy-phenyl] 3-nitrobenzoate Openeye Name: [4-[(4-bromophenyl)iminomethyl]-2-methoxy-phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(4-bromophenyl)iminomethyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(4-bromophenyl)iminomethyl]-2-methoxyphenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(4-bromophenyl)iminomethyl]-2-methoxy-phenyl] ester Formula: C21H15BrN2O5 MolecularWeight: 455.2582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15BrN2O5/c1-28-20-11-14(13-23-17-8-6-16(22)7-9-17)5-10-19(20)29-21(25)15-3-2-4-18(12-15)24(26)27/h2-13H,1H3