[(2S)-3-methylbutan-2-yl]-[(1R)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium

Systemtic Name: [(2S)-3-methylbutan-2-yl]-[(1R)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium Openeye Name: [(1S)-1,2-dimethylpropyl]-[(1R)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium CAS Name: [(2S)-3-methylbutan-2-yl]-[(1R)-1-(4-methyl-3-nitrophenyl)ethyl]ammonium IUPAC Name: [(2S)-3-methylbutan-2-yl]-[(1R)-1-(4-methyl-3-nitrophenyl)ethyl]azanium Traditional Name: [(1S)-1,2-dimethylpropyl]-[(1R)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium Formula: C14H23N2O2+ MolecularWeight: 251.34462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]C(C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@@H](C)[NH2+][C@@H](C)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H22N2O2/c1-9(2)11(4)15-12(5)13-7-6-10(3)14(8-13)16(17)18/h6-9,11-12,15H,1-5H3/p+1/t11-,12+/m0/s1