2,3,4-tris(fluoranyl)-N-(4-piperazin-4-ium-1-ylphenyl)benzamide

Systemtic Name: 2,3,4-tris(fluoranyl)-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Openeye Name: 2,3,4-trifluoro-N-(4-piperazin-4-ium-1-ylphenyl)benzamide CAS Name: 2,3,4-trifluoro-N-[4-(1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 2,3,4-trifluoro-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Traditional Name: 2,3,4-trifluoro-N-(4-piperazin-4-ium-1-ylphenyl)benzamide Formula: C17H17F3N3O+ MolecularWeight: 336.33159

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC=C(C=C2)NC(=O)C3=C(C(=C(C=C3)F)F)F

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC=C(C=C2)NC(=O)C3=C(C(=C(C=C3)F)F)F

InChI

InChI=1S/C17H16F3N3O/c18-14-6-5-13(15(19)16(14)20)17(24)22-11-1-3-12(4-2-11)23-9-7-21-8-10-23/h1-6,21H,7-10H2,(H,22,24)/p+1