[azanyl-[3-fluoranyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]methylidene]azanium

Systemtic Name: [azanyl-[3-fluoranyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]methylidene]azanium Openeye Name: [amino-[3-fluoro-4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]methylene]ammonium CAS Name: [amino-[3-fluoro-4-[(4-methyl-1-piperazin-4-iumyl)methyl]phenyl]methylidene]ammonium IUPAC Name: [amino-[3-fluoro-4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]methylidene]azanium Traditional Name: [amino-[3-fluoro-4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]methylene]ammonium Formula: C13H21FN4+2 MolecularWeight: 252.331043

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=C(C=C(C=C2)C(=[NH2+])N)F

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=C(C=C(C=C2)C(=[NH2+])N)F

InChI

InChI=1S/C13H19FN4/c1-17-4-6-18(7-5-17)9-11-3-2-10(13(15)16)8-12(11)14/h2-3,8H,4-7,9H2,1H3,(H3,15,16)/p+2