N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]-1-(2-nitrophenyl)methanimine

Systemtic Name: N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]-1-(2-nitrophenyl)methanimine Openeye Name: 1-(2-nitrophenyl)-N-[4-(p-tolylmethyl)piperazin-4-ium-1-yl]methanimine CAS Name: N-[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]-1-(2-nitrophenyl)methanimine IUPAC Name: N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]-1-(2-nitrophenyl)methanimine Traditional Name: (E)-[4-(4-methylbenzyl)piperazin-4-ium-1-yl]-(2-nitrobenzylidene)amine Formula: C19H23N4O2+ MolecularWeight: 339.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)N=CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)/N=C/C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O2/c1-16-6-8-17(9-7-16)15-21-10-12-22(13-11-21)20-14-18-4-2-3-5-19(18)23(24)25/h2-9,14H,10-13,15H2,1H3/p+1/b20-14+