4-(phenylmethyl)-N-[6-[[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylamino]hexyl]piperazin-4-ium-1-carboxamide

Systemtic Name: 4-(phenylmethyl)-N-[6-[[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylamino]hexyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-benzyl-N-[6-[(4-benzylpiperazin-4-ium-1-carbonyl)amino]hexyl]piperazin-4-ium-1-carboxamide CAS Name: N-[6-[[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]amino]hexyl]-4-(phenylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-benzyl-N-[6-[(4-benzylpiperazin-4-ium-1-carbonyl)amino]hexyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-benzyl-N-[6-[(4-benzylpiperazin-4-ium-1-carbonyl)amino]hexyl]piperazin-4-ium-1-carboxamide Formula: C30H46N6O2+2 MolecularWeight: 522.72524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)NCCCCCCNC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)NCCCCCCNC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C30H44N6O2/c37-29(35-21-17-33(18-22-35)25-27-11-5-3-6-12-27)31-15-9-1-2-10-16-32-30(38)36-23-19-34(20-24-36)26-28-13-7-4-8-14-28/h3-8,11-14H,1-2,9-10,15-26H2,(H,31,37)(H,32,38)/p+2