1-(2,4-dinitrophenyl)-4-(naphthalen-1-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(2,4-dinitrophenyl)-4-(naphthalen-1-ylmethyl)piperazin-4-ium Openeye Name: 1-(2,4-dinitrophenyl)-4-(1-naphthylmethyl)piperazin-4-ium CAS Name: 1-(2,4-dinitrophenyl)-4-(1-naphthalenylmethyl)piperazin-4-ium IUPAC Name: 1-(2,4-dinitrophenyl)-4-(naphthalen-1-ylmethyl)piperazin-4-ium Traditional Name: 1-(2,4-dinitrophenyl)-4-(1-naphthylmethyl)piperazin-4-ium Formula: C21H21N4O4+ MolecularWeight: 393.41584

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4/c26-24(27)18-8-9-20(21(14-18)25(28)29)23-12-10-22(11-13-23)15-17-6-3-5-16-4-1-2-7-19(16)17/h1-9,14H,10-13,15H2/p+1