4-bromanyl-N-(3-imidazol-1-ylpropyl)-2-nitro-aniline

Systemtic Name: 4-bromanyl-N-(3-imidazol-1-ylpropyl)-2-nitro-aniline Openeye Name: 4-bromo-N-(3-imidazol-1-ylpropyl)-2-nitro-aniline CAS Name: 4-bromo-N-[3-(1-imidazolyl)propyl]-2-nitroaniline IUPAC Name: 4-bromo-N-(3-imidazol-1-ylpropyl)-2-nitroaniline Traditional Name: (4-bromo-2-nitro-phenyl)-(3-imidazol-1-ylpropyl)amine Formula: C12H13BrN4O2 MolecularWeight: 325.16122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)[N+](=O)[O-])NCCCN2C=CN=C2

Isomeric SMILES

C1=CC(=C(C=C1Br)[N+](=O)[O-])NCCCN2C=CN=C2

InChI

InChI=1S/C12H13BrN4O2/c13-10-2-3-11(12(8-10)17(18)19)15-4-1-6-16-7-5-14-9-16/h2-3,5,7-9,15H,1,4,6H2