1-[4-(2-chloranylphenoxy)-3-nitro-phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[4-(2-chloranylphenoxy)-3-nitro-phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[4-(2-chlorophenoxy)-3-nitro-phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[4-(2-chlorophenoxy)-3-nitrophenyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[4-(2-chlorophenoxy)-3-nitrophenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-[4-(2-chlorophenoxy)-3-nitro-benzylidene]-(4-methylpiperazin-4-ium-1-yl)amine Formula: C18H20ClN4O3+ MolecularWeight: 375.8294

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)N=CC2=CC(=C(C=C2)OC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)/N=C\C2=CC(=C(C=C2)OC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClN4O3/c1-21-8-10-22(11-9-21)20-13-14-6-7-18(16(12-14)23(24)25)26-17-5-3-2-4-15(17)19/h2-7,12-13H,8-11H2,1H3/p+1/b20-13-