N-(2,6-dimethylphenyl)-2-(4-quinoxalin-6-ylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-(4-quinoxalin-6-ylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(quinoxaline-6-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[oxo(6-quinoxalinyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(quinoxaline-6-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(quinoxaline-6-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C23H26N5O2+ MolecularWeight: 404.48484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC4=NC=CN=C4C=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C23H25N5O2/c1-16-4-3-5-17(2)22(16)26-21(29)15-27-10-12-28(13-11-27)23(30)18-6-7-19-20(14-18)25-9-8-24-19/h3-9,14H,10-13,15H2,1-2H3,(H,26,29)/p+1