(3-fluorophenyl)-[4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-fluorophenyl)-[4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-fluorophenyl)-[4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (3-fluorophenyl)-[4-[(3-phenoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-fluorophenyl)-[4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3-fluorophenyl)-[4-(3-phenoxybenzyl)piperazin-4-ium-1-yl]methanone Formula: C24H24FN2O2+ MolecularWeight: 391.457963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C24H23FN2O2/c25-21-8-5-7-20(17-21)24(28)27-14-12-26(13-15-27)18-19-6-4-11-23(16-19)29-22-9-2-1-3-10-22/h1-11,16-17H,12-15,18H2/p+1