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

Systemtic Name: 1-[(4-methylphenyl)methyl]-4-[(2-nitrophenyl)methyl]piperazin-4-ium Openeye Name: 1-[(2-nitrophenyl)methyl]-4-(p-tolylmethyl)piperazin-1-ium CAS Name: 1-[(4-methylphenyl)methyl]-4-[(2-nitrophenyl)methyl]piperazin-4-ium IUPAC Name: 1-[(4-methylphenyl)methyl]-4-[(2-nitrophenyl)methyl]piperazin-4-ium Traditional Name: 1-(4-methylbenzyl)-4-(2-nitrobenzyl)piperazin-4-ium Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC[NH+](CC2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC[NH+](CC2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O2/c1-16-6-8-17(9-7-16)14-20-10-12-21(13-11-20)15-18-4-2-3-5-19(18)22(23)24/h2-9H,10-15H2,1H3/p+1