4-(1-imidazol-1-ylbutyl)-2-nitro-aniline

Systemtic Name: 4-(1-imidazol-1-ylbutyl)-2-nitro-aniline Openeye Name: 4-(1-imidazol-1-ylbutyl)-2-nitro-aniline CAS Name: 4-[1-(1-imidazolyl)butyl]-2-nitroaniline IUPAC Name: 4-(1-imidazol-1-ylbutyl)-2-nitroaniline Traditional Name: [4-(1-imidazol-1-ylbutyl)-2-nitro-phenyl]amine Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=C(C=C1)N)[N+](=O)[O-])N2C=CN=C2

Isomeric SMILES

CCCC(C1=CC(=C(C=C1)N)[N+](=O)[O-])N2C=CN=C2

InChI

InChI=1S/C13H16N4O2/c1-2-3-12(16-7-6-15-9-16)10-4-5-11(14)13(8-10)17(18)19/h4-9,12H,2-3,14H2,1H3