1-[(3-bromanyl-4-methoxy-phenyl)methyl]-4-nitro-imidazole

Systemtic Name: 1-[(3-bromanyl-4-methoxy-phenyl)methyl]-4-nitro-imidazole Openeye Name: 1-[(3-bromo-4-methoxy-phenyl)methyl]-4-nitro-imidazole CAS Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-nitroimidazole IUPAC Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-nitroimidazole Traditional Name: 1-(3-bromo-4-methoxy-benzyl)-4-nitro-imidazole Formula: C11H10BrN3O3 MolecularWeight: 312.1194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C=C(N=C2)[N+](=O)[O-])Br

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C=C(N=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C11H10BrN3O3/c1-18-10-3-2-8(4-9(10)12)5-14-6-11(13-7-14)15(16)17/h2-4,6-7H,5H2,1H3