[(S)-(3,5-dimethylphenyl)-(2-methyl-5-nitro-phenyl)methyl]azanium

Systemtic Name: [(S)-(3,5-dimethylphenyl)-(2-methyl-5-nitro-phenyl)methyl]azanium Openeye Name: [(S)-(3,5-dimethylphenyl)-(2-methyl-5-nitro-phenyl)methyl]ammonium CAS Name: [(S)-(3,5-dimethylphenyl)-(2-methyl-5-nitrophenyl)methyl]ammonium IUPAC Name: [(S)-(3,5-dimethylphenyl)-(2-methyl-5-nitrophenyl)methyl]azanium Traditional Name: [(S)-(3,5-dimethylphenyl)-(2-methyl-5-nitro-phenyl)methyl]ammonium Formula: C16H19N2O2+ MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC(=CC(=C2)C)C)[NH3+]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])[C@H](C2=CC(=CC(=C2)C)C)[NH3+]

InChI

InChI=1S/C16H18N2O2/c1-10-6-11(2)8-13(7-10)16(17)15-9-14(18(19)20)5-4-12(15)3/h4-9,16H,17H2,1-3H3/p+1/t16-/m0/s1