[4-(2-fluorophenyl)piperazin-1-yl]-(6-phenyl-2-pyrrolidin-1-yl-pyridin-1-ium-3-yl)methanone

Systemtic Name: [4-(2-fluorophenyl)piperazin-1-yl]-(6-phenyl-2-pyrrolidin-1-yl-pyridin-1-ium-3-yl)methanone Openeye Name: [4-(2-fluorophenyl)piperazin-1-yl]-(6-phenyl-2-pyrrolidin-1-yl-pyridin-1-ium-3-yl)methanone CAS Name: [4-(2-fluorophenyl)-1-piperazinyl]-[6-phenyl-2-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methanone IUPAC Name: [4-(2-fluorophenyl)piperazin-1-yl]-(6-phenyl-2-pyrrolidin-1-ylpyridin-1-ium-3-yl)methanone Traditional Name: [4-(2-fluorophenyl)piperazino]-(6-phenyl-2-pyrrolidino-pyridin-1-ium-3-yl)methanone Formula: C26H28FN4O+ MolecularWeight: 431.525123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC(=[NH+]2)C3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5F

Isomeric SMILES

C1CCN(C1)C2=C(C=CC(=[NH+]2)C3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5F

InChI

InChI=1S/C26H27FN4O/c27-22-10-4-5-11-24(22)29-16-18-31(19-17-29)26(32)21-12-13-23(20-8-2-1-3-9-20)28-25(21)30-14-6-7-15-30/h1-5,8-13H,6-7,14-19H2/p+1