N-(3-cyanophenyl)-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-cyanophenyl)-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(3-cyanophenyl)acetamide CAS Name: N-(3-cyanophenyl)-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(3-cyanophenyl)acetamide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(3-cyanophenyl)acetamide Formula: C20H23N4O+ MolecularWeight: 335.42282

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)C#N)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)C#N)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O/c21-14-18-7-4-8-19(13-18)22-20(25)16-24-11-9-23(10-12-24)15-17-5-2-1-3-6-17/h1-8,13H,9-12,15-16H2,(H,22,25)/p+1