N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C20H19BrN4O5 MolecularWeight: 475.29266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])Br)OC

InChI

InChI=1S/C20H19BrN4O5/c1-29-18-10-13(15(21)11-19(18)30-2)5-6-23-20(26)14-3-4-16(17(9-14)25(27)28)24-8-7-22-12-24/h3-4,7-12H,5-6H2,1-2H3,(H,23,26)