2-[2-azanyl-3-methyl-4-(4-methylphenyl)imidazol-1-ium-1-yl]-1-(3-nitrophenyl)ethanone

Systemtic Name: 2-[2-azanyl-3-methyl-4-(4-methylphenyl)imidazol-1-ium-1-yl]-1-(3-nitrophenyl)ethanone Openeye Name: 2-[2-amino-3-methyl-4-(p-tolyl)imidazol-1-ium-1-yl]-1-(3-nitrophenyl)ethanone CAS Name: 2-[2-amino-3-methyl-4-(4-methylphenyl)-1-imidazol-1-iumyl]-1-(3-nitrophenyl)ethanone IUPAC Name: 2-[2-amino-3-methyl-4-(4-methylphenyl)imidazol-1-ium-1-yl]-1-(3-nitrophenyl)ethanone Traditional Name: 2-[2-amino-3-methyl-4-(p-tolyl)imidazol-1-ium-1-yl]-1-(3-nitrophenyl)ethanone Formula: C19H19N4O3+ MolecularWeight: 351.37916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C[N+](=C(N2C)N)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C[N+](=C(N2C)N)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O3/c1-13-6-8-14(9-7-13)17-11-22(19(20)21(17)2)12-18(24)15-4-3-5-16(10-15)23(25)26/h3-11,20H,12H2,1-2H3/p+1