2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-cyclopropyl-N-[(2-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-cyclopropyl-N-[(2-fluorophenyl)methyl]ethanamide Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide CAS Name: 2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide Traditional Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-cyclopropyl-N-(2-fluorobenzyl)acetamide Formula: C22H26ClFN3O+ MolecularWeight: 402.912743

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=CC=C2F)C(=O)C[NH+]3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CC1N(CC2=CC=CC=C2F)C(=O)C[NH+]3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H25ClFN3O/c23-18-5-3-6-20(14-18)26-12-10-25(11-13-26)16-22(28)27(19-8-9-19)15-17-4-1-2-7-21(17)24/h1-7,14,19H,8-13,15-16H2/p+1