2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(pyrimidin-4-ylmethyl)ethanamide

Systemtic Name: 2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(pyrimidin-4-ylmethyl)ethanamide Openeye Name: 2-[(2R)-1-(2-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]-N-(pyrimidin-4-ylmethyl)acetamide CAS Name: 2-[(2R)-1-(2-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]-N-(4-pyrimidinylmethyl)acetamide IUPAC Name: 2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxopiperazin-1-ium-2-yl]-N-(pyrimidin-4-ylmethyl)acetamide Traditional Name: 2-[(2R)-3-keto-1-(2-naphthylmethyl)piperazin-1-ium-2-yl]-N-(4-pyrimidylmethyl)acetamide Formula: C22H24N5O2+ MolecularWeight: 390.45826

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCC2=NC=NC=C2)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCC2=NC=NC=C2)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H23N5O2/c28-21(25-13-19-7-8-23-15-26-19)12-20-22(29)24-9-10-27(20)14-16-5-6-17-3-1-2-4-18(17)11-16/h1-8,11,15,20H,9-10,12-14H2,(H,24,29)(H,25,28)/p+1/t20-/m1/s1