4-(1-benzofuran-7-yl)-1-[5-(4-fluorophenyl)-1H-pyrrol-2-yl]-1-methyl-piperazin-1-ium

Systemtic Name: 4-(1-benzofuran-7-yl)-1-[5-(4-fluorophenyl)-1H-pyrrol-2-yl]-1-methyl-piperazin-1-ium Openeye Name: 4-(benzofuran-7-yl)-1-[5-(4-fluorophenyl)-1H-pyrrol-2-yl]-1-methyl-piperazin-1-ium CAS Name: 4-(7-benzofuranyl)-1-[5-(4-fluorophenyl)-1H-pyrrol-2-yl]-1-methylpiperazin-1-ium IUPAC Name: 4-(1-benzofuran-7-yl)-1-[5-(4-fluorophenyl)-1H-pyrrol-2-yl]-1-methylpiperazin-1-ium Traditional Name: 4-(benzofuran-7-yl)-1-[5-(4-fluorophenyl)-1H-pyrrol-2-yl]-1-methyl-piperazin-1-ium Formula: C23H23FN3O+ MolecularWeight: 376.446623

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C2=CC=CC3=C2OC=C3)C4=CC=C(N4)C5=CC=C(C=C5)F

Isomeric SMILES

C[N+]1(CCN(CC1)C2=CC=CC3=C2OC=C3)C4=CC=C(N4)C5=CC=C(C=C5)F

InChI

InChI=1S/C23H23FN3O/c1-27(22-10-9-20(25-22)17-5-7-19(24)8-6-17)14-12-26(13-15-27)21-4-2-3-18-11-16-28-23(18)21/h2-11,16,25H,12-15H2,1H3/q+1