2-[(2R)-3-oxidanylidene-1-(phenylmethyl)piperazin-1-ium-2-yl]-N-[2-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)ethyl]ethanamide

Systemtic Name: 2-[(2R)-3-oxidanylidene-1-(phenylmethyl)piperazin-1-ium-2-yl]-N-[2-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)ethyl]ethanamide Openeye Name: 2-[(2R)-1-benzyl-3-oxo-piperazin-1-ium-2-yl]-N-[2-(6-oxo-3-phenyl-pyridazin-1-yl)ethyl]acetamide CAS Name: 2-[(2R)-3-oxo-1-(phenylmethyl)-2-piperazin-1-iumyl]-N-[2-(6-oxo-3-phenyl-1-pyridazinyl)ethyl]acetamide IUPAC Name: 2-[(2R)-1-benzyl-3-oxopiperazin-1-ium-2-yl]-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]acetamide Traditional Name: 2-[(2R)-1-benzyl-3-keto-piperazin-1-ium-2-yl]-N-[2-(6-keto-3-phenyl-pyridazin-1-yl)ethyl]acetamide Formula: C25H28N5O3+ MolecularWeight: 446.52152

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCCN2C(=O)C=CC(=N2)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCCN2C(=O)C=CC(=N2)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O3/c31-23(17-22-25(33)27-13-15-29(22)18-19-7-3-1-4-8-19)26-14-16-30-24(32)12-11-21(28-30)20-9-5-2-6-10-20/h1-12,22H,13-18H2,(H,26,31)(H,27,33)/p+1/t22-/m1/s1