N-[3-[4-(phenylmethyl)piperazin-1-ium-1-yl]propyl]quinoxaline-2-carboxamide

Systemtic Name: N-[3-[4-(phenylmethyl)piperazin-1-ium-1-yl]propyl]quinoxaline-2-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-ium-1-yl)propyl]quinoxaline-2-carboxamide CAS Name: N-[3-[4-(phenylmethyl)-1-piperazin-1-iumyl]propyl]-2-quinoxalinecarboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-ium-1-yl)propyl]quinoxaline-2-carboxamide Traditional Name: N-[3-(4-benzylpiperazin-1-ium-1-yl)propyl]quinoxaline-2-carboxamide Formula: C23H28N5O+ MolecularWeight: 390.50132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCNC(=O)C2=NC3=CC=CC=C3N=C2)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCCNC(=O)C2=NC3=CC=CC=C3N=C2)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O/c29-23(22-17-25-20-9-4-5-10-21(20)26-22)24-11-6-12-27-13-15-28(16-14-27)18-19-7-2-1-3-8-19/h1-5,7-10,17H,6,11-16,18H2,(H,24,29)/p+1