[(S)-(3,4-dimethyl-5-nitro-phenyl)-(2-methylphenyl)methyl]azanium

Systemtic Name: [(S)-(3,4-dimethyl-5-nitro-phenyl)-(2-methylphenyl)methyl]azanium Openeye Name: [(S)-(3,4-dimethyl-5-nitro-phenyl)-(o-tolyl)methyl]ammonium CAS Name: [(S)-(3,4-dimethyl-5-nitrophenyl)-(2-methylphenyl)methyl]ammonium IUPAC Name: [(S)-(3,4-dimethyl-5-nitrophenyl)-(2-methylphenyl)methyl]azanium Traditional Name: [(S)-(3,4-dimethyl-5-nitro-phenyl)-(o-tolyl)methyl]ammonium Formula: C16H19N2O2+ MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC(=C(C(=C2)[N+](=O)[O-])C)C)[NH3+]

Isomeric SMILES

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

InChI

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