4-(3-cyanopyridin-1-ium-2-yl)-N-(2-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-(3-cyanopyridin-1-ium-2-yl)-N-(2-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-(3-cyanopyridin-1-ium-2-yl)-N-(2-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-(3-cyano-2-pyridin-1-iumyl)-N-(2-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-(3-cyanopyridin-1-ium-2-yl)-N-(2-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-(3-cyanopyridin-1-ium-2-yl)-N-(2-fluorophenyl)piperazine-1-carboxamide Formula: C17H17FN5O+ MolecularWeight: 326.348183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=[NH+]2)C#N)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=[NH+]2)C#N)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C17H16FN5O/c18-14-5-1-2-6-15(14)21-17(24)23-10-8-22(9-11-23)16-13(12-19)4-3-7-20-16/h1-7H,8-11H2,(H,21,24)/p+1