(4-dimethylaminophenyl)methyl-methyl-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-methyl-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-methyl-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-methyl-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-methyl-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-methyl-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]ammonium Formula: C19H23N6O2+ MolecularWeight: 367.42492

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)N(C)C)CN2C=NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)N(C)C)CN2C=NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N6O2/c1-22(2)17-8-4-15(5-9-17)12-23(3)14-24-13-20-19(21-24)16-6-10-18(11-7-16)25(26)27/h4-11,13H,12,14H2,1-3H3/p+1