3-methyl-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-4-nitro-aniline

Systemtic Name: 3-methyl-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-4-nitro-aniline Openeye Name: 3-methyl-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-4-nitro-aniline CAS Name: 3-methyl-N-[3-(3-methyl-1-imidazol-3-iumyl)propyl]-4-nitroaniline IUPAC Name: 3-methyl-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-4-nitroaniline Traditional Name: 3-(3-methylimidazol-3-ium-1-yl)propyl-(3-methyl-4-nitro-phenyl)amine Formula: C14H19N4O2+ MolecularWeight: 275.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NCCCN2C=C[N+](=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)NCCCN2C=C[N+](=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H19N4O2/c1-12-10-13(4-5-14(12)18(19)20)15-6-3-7-17-9-8-16(2)11-17/h4-5,8-11,15H,3,6-7H2,1-2H3/q+1