2-[4-(2,3-diethylquinoxalin-6-yl)carbonylpiperazin-1-ium-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-(2,3-diethylquinoxalin-6-yl)carbonylpiperazin-1-ium-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-(2,3-diethylquinoxaline-6-carbonyl)piperazin-1-ium-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[(2,3-diethyl-6-quinoxalinyl)-oxomethyl]-1-piperazin-1-iumyl]-N-phenylacetamide IUPAC Name: 2-[4-(2,3-diethylquinoxaline-6-carbonyl)piperazin-1-ium-1-yl]-N-phenylacetamide Traditional Name: 2-[4-(2,3-diethylquinoxaline-6-carbonyl)piperazin-1-ium-1-yl]-N-phenyl-acetamide Formula: C25H30N5O2+ MolecularWeight: 432.538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)C(=O)N3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4)N=C1CC

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)C(=O)N3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4)N=C1CC

InChI

InChI=1S/C25H29N5O2/c1-3-20-21(4-2)28-23-16-18(10-11-22(23)27-20)25(32)30-14-12-29(13-15-30)17-24(31)26-19-8-6-5-7-9-19/h5-11,16H,3-4,12-15,17H2,1-2H3,(H,26,31)/p+1