[(1R,2S)-2-[(2,4-dinitrophenyl)amino]cyclohexyl]azanium

Systemtic Name: [(1R,2S)-2-[(2,4-dinitrophenyl)amino]cyclohexyl]azanium Openeye Name: [(1R,2S)-2-(2,4-dinitroanilino)cyclohexyl]ammonium CAS Name: [(1R,2S)-2-(2,4-dinitroanilino)cyclohexyl]ammonium IUPAC Name: [(1R,2S)-2-(2,4-dinitroanilino)cyclohexyl]azanium Traditional Name: [(1R,2S)-2-(2,4-dinitroanilino)cyclohexyl]ammonium Formula: C12H17N4O4+ MolecularWeight: 281.28778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)[NH3+])NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)[NH3+])NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O4/c13-9-3-1-2-4-10(9)14-11-6-5-8(15(17)18)7-12(11)16(19)20/h5-7,9-10,14H,1-4,13H2/p+1/t9-,10+/m1/s1