1-(2,6-dinitrophenyl)-4-(diphenylmethyl)piperazin-4-ium

Systemtic Name: 1-(2,6-dinitrophenyl)-4-(diphenylmethyl)piperazin-4-ium Openeye Name: 1-benzhydryl-4-(2,6-dinitrophenyl)piperazin-1-ium CAS Name: 1-(2,6-dinitrophenyl)-4-(diphenylmethyl)piperazin-4-ium IUPAC Name: 1-benzhydryl-4-(2,6-dinitrophenyl)piperazin-1-ium Traditional Name: 1-benzhydryl-4-(2,6-dinitrophenyl)piperazin-1-ium Formula: C23H23N4O4+ MolecularWeight: 419.45312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=C(C=CC=C4[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=C(C=CC=C4[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O4/c28-26(29)20-12-7-13-21(27(30)31)23(20)25-16-14-24(15-17-25)22(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-13,22H,14-17H2/p+1