5-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-3-phenyl-1,2-oxazole-4-carboxamide

Systemtic Name: 5-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-3-phenyl-1,2-oxazole-4-carboxamide Openeye Name: 5-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-3-phenyl-isoxazole-4-carboxamide CAS Name: 5-methyl-N-[[4-(4-methyl-1-piperazin-4-iumyl)phenyl]methyl]-3-phenyl-4-isoxazolecarboxamide IUPAC Name: 5-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-3-phenyl-1,2-oxazole-4-carboxamide Traditional Name: 5-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)benzyl]-3-phenyl-isoxazole-4-carboxamide Formula: C23H27N4O2+ MolecularWeight: 391.48608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C23H26N4O2/c1-17-21(22(25-29-17)19-6-4-3-5-7-19)23(28)24-16-18-8-10-20(11-9-18)27-14-12-26(2)13-15-27/h3-11H,12-16H2,1-2H3,(H,24,28)/p+1