6-[3-(4-fluorophenyl)-1-(triphenylmethyl)pyrazol-1-ium-1-yl]-4-(4-methylpiperazin-1-yl)quinoline

Systemtic Name: 6-[3-(4-fluorophenyl)-1-(triphenylmethyl)pyrazol-1-ium-1-yl]-4-(4-methylpiperazin-1-yl)quinoline Openeye Name: 6-[3-(4-fluorophenyl)-1-trityl-pyrazol-1-ium-1-yl]-4-(4-methylpiperazin-1-yl)quinoline CAS Name: 6-[3-(4-fluorophenyl)-1-(triphenylmethyl)-1-pyrazol-1-iumyl]-4-(4-methyl-1-piperazinyl)quinoline IUPAC Name: 6-[3-(4-fluorophenyl)-1-tritylpyrazol-1-ium-1-yl]-4-(4-methylpiperazin-1-yl)quinoline Traditional Name: 6-[3-(4-fluorophenyl)-1-trityl-pyrazol-1-ium-1-yl]-4-(4-methylpiperazino)quinoline Formula: C42H37FN5+ MolecularWeight: 630.775083

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=C(C=CC3=NC=C2)[N+]4(C=CC(=N4)C5=CC=C(C=C5)F)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

CN1CCN(CC1)C2=C3C=C(C=CC3=NC=C2)[N+]4(C=CC(=N4)C5=CC=C(C=C5)F)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C42H37FN5/c1-46-26-28-47(29-27-46)41-23-25-44-40-22-21-37(31-38(40)41)48(30-24-39(45-48)32-17-19-36(43)20-18-32)42(33-11-5-2-6-12-33,34-13-7-3-8-14-34)35-15-9-4-10-16-35/h2-25,30-31H,26-29H2,1H3/q+1