N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide

Systemtic Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide Openeye Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide CAS Name: N-[3-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-quinoxalinecarboxamide IUPAC Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide Traditional Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide Formula: C21H24N5O+ MolecularWeight: 362.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)N4CC[NH+](CC4)C

InChI

InChI=1S/C21H23N5O/c1-15-13-16(7-8-20(15)26-11-9-25(2)10-12-26)23-21(27)19-14-22-17-5-3-4-6-18(17)24-19/h3-8,13-14H,9-12H2,1-2H3,(H,23,27)/p+1