N-(3-fluorophenyl)-4-(furan-2-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(3-fluorophenyl)-4-(furan-2-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(3-fluorophenyl)-4-(2-furylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(3-fluorophenyl)-4-(2-furanylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3-fluorophenyl)-4-(furan-2-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(3-fluorophenyl)-4-(2-furfuryl)piperazin-4-ium-1-carboxamide Formula: C16H19FN3O2+ MolecularWeight: 304.339363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C16H18FN3O2/c17-13-3-1-4-14(11-13)18-16(21)20-8-6-19(7-9-20)12-15-5-2-10-22-15/h1-5,10-11H,6-9,12H2,(H,18,21)/p+1