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

Systemtic Name: 4-[(3-chlorophenyl)methyl]-N-(phenylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-benzyl-4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-carboxamide CAS Name: 4-[(3-chlorophenyl)methyl]-N-(phenylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-benzyl-4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-benzyl-4-(3-chlorobenzyl)piperazin-4-ium-1-carboxamide Formula: C19H23ClN3O+ MolecularWeight: 344.85842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H22ClN3O/c20-18-8-4-7-17(13-18)15-22-9-11-23(12-10-22)19(24)21-14-16-5-2-1-3-6-16/h1-8,13H,9-12,14-15H2,(H,21,24)/p+1