N-methyl-2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-phenethyl-ethanamide

Systemtic Name: N-methyl-2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-phenethyl-ethanamide Openeye Name: N-methyl-2-[(2R)-1-(2-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]-N-phenethyl-acetamide CAS Name: N-methyl-2-[(2R)-1-(2-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]-N-phenethylacetamide IUPAC Name: N-methyl-2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxopiperazin-1-ium-2-yl]-N-phenethylacetamide Traditional Name: 2-[(2R)-3-keto-1-(2-naphthylmethyl)piperazin-1-ium-2-yl]-N-methyl-N-phenethyl-acetamide Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)CC2C(=O)NCC[NH+]2CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H29N3O2/c1-28(15-13-20-7-3-2-4-8-20)25(30)18-24-26(31)27-14-16-29(24)19-21-11-12-22-9-5-6-10-23(22)17-21/h2-12,17,24H,13-16,18-19H2,1H3,(H,27,31)/p+1/t24-/m1/s1