N-naphthalen-1-yl-4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-naphthalen-1-yl-4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-[2-(benzylamino)-2-oxo-ethyl]-N-(1-naphthyl)piperazin-4-ium-1-carboxamide CAS Name: N-(1-naphthalenyl)-4-[2-oxo-2-[(phenylmethyl)amino]ethyl]-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[2-(benzylamino)-2-oxoethyl]-N-naphthalen-1-ylpiperazin-4-ium-1-carboxamide Traditional Name: 4-[2-(benzylamino)-2-keto-ethyl]-N-(1-naphthyl)piperazin-4-ium-1-carboxamide Formula: C24H27N4O2+ MolecularWeight: 403.49678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCC2=CC=CC=C2)C(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCC2=CC=CC=C2)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H26N4O2/c29-23(25-17-19-7-2-1-3-8-19)18-27-13-15-28(16-14-27)24(30)26-22-12-6-10-20-9-4-5-11-21(20)22/h1-12H,13-18H2,(H,25,29)(H,26,30)/p+1