N-(4-chloranyl-2-nitro-phenyl)-1-methyl-pyrrol-1-ium-1-amine

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-1-methyl-pyrrol-1-ium-1-amine Openeye Name: N-(4-chloro-2-nitro-phenyl)-1-methyl-pyrrol-1-ium-1-amine CAS Name: N-(4-chloro-2-nitrophenyl)-1-methyl-1-pyrrol-1-iumamine IUPAC Name: N-(4-chloro-2-nitrophenyl)-1-methylpyrrol-1-ium-1-amine Traditional Name: (4-chloro-2-nitro-phenyl)-(1-methylpyrrol-1-ium-1-yl)amine Formula: C11H11ClN3O2+ MolecularWeight: 252.67694

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C=CC=C1)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[N+]1(C=CC=C1)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H11ClN3O2/c1-15(6-2-3-7-15)13-10-5-4-9(12)8-11(10)14(16)17/h2-8,13H,1H3/q+1