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

Systemtic Name: 2-naphthalen-1-yl-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]ethanamide Openeye Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-(1-naphthyl)acetamide CAS Name: 2-(1-naphthalenyl)-N-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-(1-naphthyl)acetamide Formula: C29H30N3O+ MolecularWeight: 436.568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H29N3O/c33-29(21-25-11-6-10-24-9-4-5-12-28(24)25)30-26-13-15-27(16-14-26)32-19-17-31(18-20-32)22-23-7-2-1-3-8-23/h1-16H,17-22H2,(H,30,33)/p+1