[(1S,2R,3S)-2,3-dimethylcyclohexyl]-[(2-nitrophenyl)methyl]azanium

Systemtic Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-[(2-nitrophenyl)methyl]azanium Openeye Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-[(2-nitrophenyl)methyl]ammonium CAS Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-[(2-nitrophenyl)methyl]ammonium IUPAC Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-[(2-nitrophenyl)methyl]azanium Traditional Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-(2-nitrobenzyl)ammonium Formula: C15H23N2O2+ MolecularWeight: 263.35532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)[NH2+]CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)[NH2+]CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O2/c1-11-6-5-8-14(12(11)2)16-10-13-7-3-4-9-15(13)17(18)19/h3-4,7,9,11-12,14,16H,5-6,8,10H2,1-2H3/p+1/t11-,12+,14-/m0/s1