2-bromanyl-4,6-dinitro-aniline; N-cyclohexylpyrazol-1-amine

Systemtic Name: 2-bromanyl-4,6-dinitro-aniline; N-cyclohexylpyrazol-1-amine Openeye Name: 2-bromo-4,6-dinitro-aniline; N-cyclohexylpyrazol-1-amine CAS Name: 2-bromo-4,6-dinitroaniline; N-cyclohexyl-1-pyrazolamine IUPAC Name: 2-bromo-4,6-dinitroaniline; N-cyclohexylpyrazol-1-amine Traditional Name: (2-bromo-4,6-dinitro-phenyl)amine; cyclohexyl(pyrazol-1-yl)amine Formula: C15H19BrN6O4 MolecularWeight: 427.25316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NN2C=CC=N2.C1=C(C=C(C(=C1[N+](=O)[O-])N)Br)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NN2C=CC=N2.C1=C(C=C(C(=C1[N+](=O)[O-])N)Br)[N+](=O)[O-]

InChI

InChI=1S/C9H15N3.C6H4BrN3O4/c1-2-5-9(6-3-1)11-12-8-4-7-10-12;7-4-1-3(9(11)12)2-5(6(4)8)10(13)14/h4,7-9,11H,1-3,5-6H2;1-2H,8H2