N-(4-chlorophenyl)-3-[4-(phenylmethyl)piperazin-1-ium-1-yl]propanamide chloride

Systemtic Name: N-(4-chlorophenyl)-3-[4-(phenylmethyl)piperazin-1-ium-1-yl]propanamide chloride Openeye Name: 3-(4-benzylpiperazin-1-ium-1-yl)-N-(4-chlorophenyl)propanamide chloride CAS Name: N-(4-chlorophenyl)-3-[4-(phenylmethyl)-1-piperazin-1-iumyl]propanamide chloride IUPAC Name: 3-(4-benzylpiperazin-1-ium-1-yl)-N-(4-chlorophenyl)propanamide chloride Traditional Name: 3-(4-benzylpiperazin-1-ium-1-yl)-N-(4-chlorophenyl)propionamide chloride Formula: C20H25Cl2N3O MolecularWeight: 394.338

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=CC=C(C=C2)Cl)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=CC=C(C=C2)Cl)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H24ClN3O.ClH/c21-18-6-8-19(9-7-18)22-20(25)10-11-23-12-14-24(15-13-23)16-17-4-2-1-3-5-17;/h1-9H,10-16H2,(H,22,25);1H