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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propanamide CAS Name: N-(3-chloro-2-methylphenyl)-3-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: N-(3-chloro-2-methylphenyl)-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propionamide Formula: C20H24ClFN3O+ MolecularWeight: 376.875463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C20H23ClFN3O/c1-15-16(21)5-4-7-18(15)23-20(26)9-10-24-11-13-25(14-12-24)19-8-3-2-6-17(19)22/h2-8H,9-14H2,1H3,(H,23,26)/p+1