N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=NC4=CC=CC=C4N=C3

InChI

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