N-(4-chloranyl-2-fluoranyl-phenyl)-3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propanamide CAS Name: N-(4-chloro-2-fluorophenyl)-3-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propionamide Formula: C19H21Cl2FN3O+ MolecularWeight: 397.293943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=C(C=C(C=C2)Cl)F)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=C(C=C(C=C2)Cl)F)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H20Cl2FN3O/c20-14-2-1-3-16(12-14)25-10-8-24(9-11-25)7-6-19(26)23-18-5-4-15(21)13-17(18)22/h1-5,12-13H,6-11H2,(H,23,26)/p+1