N-(2-chloranyl-4-fluoranyl-phenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2-chloro-4-fluorophenyl)-2-[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Formula: C20H25ClFN3O2+2 MolecularWeight: 393.882803

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCOC2=CC=CC=C2)CC(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1C[NH+](CC[NH+]1CCOC2=CC=CC=C2)CC(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C20H23ClFN3O2/c21-18-14-16(22)6-7-19(18)23-20(26)15-25-10-8-24(9-11-25)12-13-27-17-4-2-1-3-5-17/h1-7,14H,8-13,15H2,(H,23,26)/p+2