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

Systemtic Name: 2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(1-phenylcyclopropyl)ethanamide Openeye Name: 2-[(2R)-1-(2-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]-N-(1-phenylcyclopropyl)acetamide CAS Name: 2-[(2R)-1-(2-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]-N-(1-phenylcyclopropyl)acetamide IUPAC Name: 2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxopiperazin-1-ium-2-yl]-N-(1-phenylcyclopropyl)acetamide Traditional Name: 2-[(2R)-3-keto-1-(2-naphthylmethyl)piperazin-1-ium-2-yl]-N-(1-phenylcyclopropyl)acetamide Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC=CC=C2)NC(=O)CC3C(=O)NCC[NH+]3CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CC1(C2=CC=CC=C2)NC(=O)C[C@@H]3C(=O)NCC[NH+]3CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H27N3O2/c30-24(28-26(12-13-26)22-8-2-1-3-9-22)17-23-25(31)27-14-15-29(23)18-19-10-11-20-6-4-5-7-21(20)16-19/h1-11,16,23H,12-15,17-18H2,(H,27,31)(H,28,30)/p+1/t23-/m1/s1