4-[2-(2-chloranylphenoxy)ethyl]-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[2-(2-chloranylphenoxy)ethyl]-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-[2-(2-chlorophenoxy)ethyl]-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-[2-(2-chlorophenoxy)ethyl]-N-(4-fluorophenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[2-(2-chlorophenoxy)ethyl]-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-[2-(2-chlorophenoxy)ethyl]-N-(4-fluorophenyl)piperazin-4-ium-1-carboxamide Formula: C19H22ClFN3O2+ MolecularWeight: 378.848283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=CC=C2Cl)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=CC=C2Cl)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C19H21ClFN3O2/c20-17-3-1-2-4-18(17)26-14-13-23-9-11-24(12-10-23)19(25)22-16-7-5-15(21)6-8-16/h1-8H,9-14H2,(H,22,25)/p+1