[(1R)-3,3-dimethyl-1-(2-methyl-5-nitro-phenyl)butyl]azanium

Systemtic Name: [(1R)-3,3-dimethyl-1-(2-methyl-5-nitro-phenyl)butyl]azanium Openeye Name: [(1R)-3,3-dimethyl-1-(2-methyl-5-nitro-phenyl)butyl]ammonium CAS Name: [(1R)-3,3-dimethyl-1-(2-methyl-5-nitrophenyl)butyl]ammonium IUPAC Name: [(1R)-3,3-dimethyl-1-(2-methyl-5-nitrophenyl)butyl]azanium Traditional Name: [(1R)-3,3-dimethyl-1-(2-methyl-5-nitro-phenyl)butyl]ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])C(CC(C)(C)C)[NH3+]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])[C@@H](CC(C)(C)C)[NH3+]

InChI

InChI=1S/C13H20N2O2/c1-9-5-6-10(15(16)17)7-11(9)12(14)8-13(2,3)4/h5-7,12H,8,14H2,1-4H3/p+1/t12-/m1/s1