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

Systemtic Name: 2-[4-(2,3-dimethylquinoxalin-6-yl)carbonylpiperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(2,3-dimethylquinoxaline-6-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[(2,3-dimethyl-6-quinoxalinyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(2,3-dimethylquinoxaline-6-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(2,3-dimethylquinoxaline-6-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C24H28N5O2+ MolecularWeight: 418.51142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)N3CC[NH+](CC3)CC(=O)NCC4=CC=CC=C4)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)N3CC[NH+](CC3)CC(=O)NCC4=CC=CC=C4)N=C1C

InChI

InChI=1S/C24H27N5O2/c1-17-18(2)27-22-14-20(8-9-21(22)26-17)24(31)29-12-10-28(11-13-29)16-23(30)25-15-19-6-4-3-5-7-19/h3-9,14H,10-13,15-16H2,1-2H3,(H,25,30)/p+1