N-[(3-chlorophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-4-[(2-fluorophenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(3-chlorobenzyl)-4-(2-fluorobenzyl)piperazin-4-ium-1-carboxamide Formula: C19H22ClFN3O+ MolecularWeight: 362.848883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)NCC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)NCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H21ClFN3O/c20-17-6-3-4-15(12-17)13-22-19(25)24-10-8-23(9-11-24)14-16-5-1-2-7-18(16)21/h1-7,12H,8-11,13-14H2,(H,22,25)/p+1