N-(phenylmethyl)-2-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-(phenylmethyl)-2-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]-1,3-oxazole-4-carboxamide Openeye Name: N-benzyl-2-[(4-benzylpiperazin-1-ium-1-yl)methyl]oxazole-4-carboxamide CAS Name: N-(phenylmethyl)-2-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]-4-oxazolecarboxamide IUPAC Name: N-benzyl-2-[(4-benzylpiperazin-1-ium-1-yl)methyl]-1,3-oxazole-4-carboxamide Traditional Name: N-benzyl-2-[(4-benzylpiperazin-1-ium-1-yl)methyl]oxazole-4-carboxamide Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=CO2)C(=O)NCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=CO2)C(=O)NCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2/c28-23(24-15-19-7-3-1-4-8-19)21-18-29-22(25-21)17-27-13-11-26(12-14-27)16-20-9-5-2-6-10-20/h1-10,18H,11-17H2,(H,24,28)/p+1