2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]-N-[2-(phenylmethyl)phenyl]ethanamide

Systemtic Name: 2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]-N-[2-(phenylmethyl)phenyl]ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(2-benzylphenyl)acetamide CAS Name: 2-(4-benzoyl-1-piperazin-1-iumyl)-N-[2-(phenylmethyl)phenyl]acetamide IUPAC Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(2-benzylphenyl)acetamide Traditional Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(2-benzylphenyl)acetamide Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2CC3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2CC3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O2/c30-25(27-24-14-8-7-13-23(24)19-21-9-3-1-4-10-21)20-28-15-17-29(18-16-28)26(31)22-11-5-2-6-12-22/h1-14H,15-20H2,(H,27,30)/p+1