dimethyl-(4-methylsulfanylphenyl)-[(4-nitrophenyl)methyl]azanium

Systemtic Name: dimethyl-(4-methylsulfanylphenyl)-[(4-nitrophenyl)methyl]azanium Openeye Name: dimethyl-(4-methylsulfanylphenyl)-[(4-nitrophenyl)methyl]ammonium CAS Name: dimethyl-[4-(methylthio)phenyl]-[(4-nitrophenyl)methyl]ammonium IUPAC Name: dimethyl-(4-methylsulfanylphenyl)-[(4-nitrophenyl)methyl]azanium Traditional Name: dimethyl-[4-(methylthio)phenyl]-(4-nitrobenzyl)ammonium Formula: C16H19N2O2S+ MolecularWeight: 303.39926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N2O2S/c1-18(2,15-8-10-16(21-3)11-9-15)12-13-4-6-14(7-5-13)17(19)20/h4-11H,12H2,1-3H3/q+1