2,3-dimethyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoxaline-6-carboxamide

Systemtic Name: 2,3-dimethyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoxaline-6-carboxamide Openeye Name: 2,3-dimethyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoxaline-6-carboxamide CAS Name: 2,3-dimethyl-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-6-quinoxalinecarboxamide IUPAC Name: 2,3-dimethyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinoxaline-6-carboxamide Traditional Name: 2,3-dimethyl-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]quinoxaline-6-carboxamide Formula: C23H27N4O+ MolecularWeight: 375.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4)N=C1C

InChI

InChI=1S/C23H26N4O/c1-16-17(2)26-22-13-18(9-10-21(22)25-16)23(28)24-14-19-7-3-4-8-20(19)15-27-11-5-6-12-27/h3-4,7-10,13H,5-6,11-12,14-15H2,1-2H3,(H,24,28)/p+1