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

Systemtic Name: 1-(naphthalen-2-ylmethyl)-4-[(2-nitrophenyl)methyl]piperazin-4-ium Openeye Name: 1-(2-naphthylmethyl)-4-[(2-nitrophenyl)methyl]piperazin-4-ium CAS Name: 1-(2-naphthalenylmethyl)-4-[(2-nitrophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(naphthalen-2-ylmethyl)-4-[(2-nitrophenyl)methyl]piperazin-4-ium Traditional Name: 1-(2-naphthylmethyl)-4-(2-nitrobenzyl)piperazin-4-ium Formula: C22H24N3O2+ MolecularWeight: 362.44486

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2[N+](=O)[O-])CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2[N+](=O)[O-])CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H23N3O2/c26-25(27)22-8-4-3-7-21(22)17-24-13-11-23(12-14-24)16-18-9-10-19-5-1-2-6-20(19)15-18/h1-10,15H,11-14,16-17H2/p+1