4-[[4-(2,3-dimethylquinoxalin-6-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(2,3-dimethylquinoxalin-6-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2,3-dimethylquinoxaline-6-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(2,3-dimethyl-6-quinoxalinyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(2,3-dimethylquinoxaline-6-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(2,3-dimethylquinoxaline-6-carbonyl)piperazino]methyl]benzonitrile Formula: C23H23N5O MolecularWeight: 385.46162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N)N=C1C

InChI

InChI=1S/C23H23N5O/c1-16-17(2)26-22-13-20(7-8-21(22)25-16)23(29)28-11-9-27(10-12-28)15-19-5-3-18(14-24)4-6-19/h3-8,13H,9-12,15H2,1-2H3