N'-(phenylmethyl)-N-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]ethanediamide

Systemtic Name: N'-(phenylmethyl)-N-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]ethanediamide Openeye Name: N'-benzyl-N-[2-(4-benzylpiperazin-4-ium-1-yl)ethyl]oxamide CAS Name: N'-(phenylmethyl)-N-[2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]oxamide IUPAC Name: N'-benzyl-N-[2-(4-benzylpiperazin-4-ium-1-yl)ethyl]oxamide Traditional Name: N'-benzyl-N-[2-(4-benzylpiperazin-4-ium-1-yl)ethyl]oxamide Formula: C22H29N4O2+ MolecularWeight: 381.49126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)CCNC(=O)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)CCNC(=O)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O2/c27-21(22(28)24-17-19-7-3-1-4-8-19)23-11-12-25-13-15-26(16-14-25)18-20-9-5-2-6-10-20/h1-10H,11-18H2,(H,23,27)(H,24,28)/p+1