N-[2,4-bis(fluoranyl)phenyl]-4-(furan-2-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-(furan-2-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(2,4-difluorophenyl)-4-(2-furylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(2,4-difluorophenyl)-4-(2-furanylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2,4-difluorophenyl)-4-(furan-2-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(2,4-difluorophenyl)-4-(2-furfuryl)piperazin-4-ium-1-carboxamide Formula: C16H18F2N3O2+ MolecularWeight: 322.329826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17F2N3O2/c17-12-3-4-15(14(18)10-12)19-16(22)21-7-5-20(6-8-21)11-13-2-1-9-23-13/h1-4,9-10H,5-8,11H2,(H,19,22)/p+1