4-(1-imidazol-1-yl-3-methyl-butyl)-2-nitro-aniline

Systemtic Name: 4-(1-imidazol-1-yl-3-methyl-butyl)-2-nitro-aniline Openeye Name: 4-(1-imidazol-1-yl-3-methyl-butyl)-2-nitro-aniline CAS Name: 4-[1-(1-imidazolyl)-3-methylbutyl]-2-nitroaniline IUPAC Name: 4-(1-imidazol-1-yl-3-methylbutyl)-2-nitroaniline Traditional Name: [4-(1-imidazol-1-yl-3-methyl-butyl)-2-nitro-phenyl]amine Formula: C14H18N4O2 MolecularWeight: 274.31832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O2/c1-10(2)7-13(17-6-5-16-9-17)11-3-4-12(15)14(8-11)18(19)20/h3-6,8-10,13H,7,15H2,1-2H3