N-(4-fluorophenyl)-1-(3-nitropyridin-1-ium-2-yl)piperidin-4-amine

Systemtic Name: N-(4-fluorophenyl)-1-(3-nitropyridin-1-ium-2-yl)piperidin-4-amine Openeye Name: N-(4-fluorophenyl)-1-(3-nitropyridin-1-ium-2-yl)piperidin-4-amine CAS Name: N-(4-fluorophenyl)-1-(3-nitro-2-pyridin-1-iumyl)-4-piperidinamine IUPAC Name: N-(4-fluorophenyl)-1-(3-nitropyridin-1-ium-2-yl)piperidin-4-amine Traditional Name: (4-fluorophenyl)-[1-(3-nitropyridin-1-ium-2-yl)-4-piperidyl]amine Formula: C16H18FN4O2+ MolecularWeight: 317.338123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=CC=C(C=C2)F)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1NC2=CC=C(C=C2)F)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

InChI

InChI=1S/C16H17FN4O2/c17-12-3-5-13(6-4-12)19-14-7-10-20(11-8-14)16-15(21(22)23)2-1-9-18-16/h1-6,9,14,19H,7-8,10-11H2/p+1