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2-nitro-5-piperazin-4-ium-1-yl-N-(pyridin-2-ylmethyl)aniline

2-nitro-5-piperazin-4-ium-1-yl-N-(pyridin-2-ylmethyl)aniline

Systemtic Name:2-nitro-5-piperazin-4-ium-1-yl-N-(pyridin-2-ylmethyl)aniline
Openeye Name:2-nitro-5-piperazin-4-ium-1-yl-N-(2-pyridylmethyl)aniline
CAS Name:2-nitro-5-(1-piperazin-4-iumyl)-N-(2-pyridinylmethyl)aniline
IUPAC Name:2-nitro-5-piperazin-4-ium-1-yl-N-(pyridin-2-ylmethyl)aniline
Traditional Name:(2-nitro-5-piperazin-4-ium-1-yl-phenyl)-(2-pyridylmethyl)amine
Formula: C16H20N5O2+
MolecularWeight: 314.3623
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=N3


Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=N3


InChI

InChI=1S/C16H19N5O2/c22-21(23)16-5-4-14(20-9-7-17-8-10-20)11-15(16)19-12-13-3-1-2-6-18-13/h1-6,11,17,19H,7-10,12H2/p+1


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