(2S)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)-2-phenyl-N-(phenylmethyl)ethanamide

Systemtic Name: (2S)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)-2-phenyl-N-(phenylmethyl)ethanamide Openeye Name: (2S)-N-benzyl-2-(3-oxopiperazin-1-ium-1-yl)-2-phenyl-acetamide CAS Name: (2S)-2-(3-oxo-1-piperazin-1-iumyl)-2-phenyl-N-(phenylmethyl)acetamide IUPAC Name: (2S)-N-benzyl-2-(3-oxopiperazin-1-ium-1-yl)-2-phenylacetamide Traditional Name: (2S)-N-benzyl-2-(3-ketopiperazin-1-ium-1-yl)-2-phenyl-acetamide Formula: C19H22N3O2+ MolecularWeight: 324.39688

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)C(C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC(=O)N1)[C@@H](C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2/c23-17-14-22(12-11-20-17)18(16-9-5-2-6-10-16)19(24)21-13-15-7-3-1-4-8-15/h1-10,18H,11-14H2,(H,20,23)(H,21,24)/p+1/t18-/m0/s1