2-chloranyl-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-6-nitro-aniline

Systemtic Name: 2-chloranyl-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-6-nitro-aniline Openeye Name: 2-chloro-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-6-nitro-aniline CAS Name: 2-chloro-N-[3-(3-methyl-1-imidazol-3-iumyl)propyl]-6-nitroaniline IUPAC Name: 2-chloro-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-6-nitroaniline Traditional Name: (2-chloro-6-nitro-phenyl)-[3-(3-methylimidazol-3-ium-1-yl)propyl]amine Formula: C13H16ClN4O2+ MolecularWeight: 295.74474

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CCCNC2=C(C=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

C[N+]1=CN(C=C1)CCCNC2=C(C=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H16ClN4O2/c1-16-8-9-17(10-16)7-3-6-15-13-11(14)4-2-5-12(13)18(19)20/h2,4-5,8-10,15H,3,6-7H2,1H3/q+1