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

Systemtic Name: N-(3-fluorophenyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Openeye Name: N-(3-fluorophenyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide CAS Name: N-(3-fluorophenyl)-4-(2-pyridin-1-iumyl)-1-piperazinecarboxamide IUPAC Name: N-(3-fluorophenyl)-4-pyridin-1-ium-2-ylpiperazine-1-carboxamide Traditional Name: N-(3-fluorophenyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Formula: C16H18FN4O+ MolecularWeight: 301.338723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C16H17FN4O/c17-13-4-3-5-14(12-13)19-16(22)21-10-8-20(9-11-21)15-6-1-2-7-18-15/h1-7,12H,8-11H2,(H,19,22)/p+1