4-chloranyl-6-(4-methylpiperazin-4-ium-1-yl)-N-(4-nitrophenyl)-1,3,5-triazin-2-amine

Systemtic Name: 4-chloranyl-6-(4-methylpiperazin-4-ium-1-yl)-N-(4-nitrophenyl)-1,3,5-triazin-2-amine Openeye Name: 4-chloro-6-(4-methylpiperazin-4-ium-1-yl)-N-(4-nitrophenyl)-1,3,5-triazin-2-amine CAS Name: 4-chloro-6-(4-methyl-1-piperazin-4-iumyl)-N-(4-nitrophenyl)-1,3,5-triazin-2-amine IUPAC Name: 4-chloro-6-(4-methylpiperazin-4-ium-1-yl)-N-(4-nitrophenyl)-1,3,5-triazin-2-amine Traditional Name: [4-chloro-6-(4-methylpiperazin-4-ium-1-yl)-s-triazin-2-yl]-(4-nitrophenyl)amine Formula: C14H17ClN7O2+ MolecularWeight: 350.78348

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=NC(=N2)Cl)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=NC(=N2)Cl)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H16ClN7O2/c1-20-6-8-21(9-7-20)14-18-12(15)17-13(19-14)16-10-2-4-11(5-3-10)22(23)24/h2-5H,6-9H2,1H3,(H,16,17,18,19)/p+1