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

Systemtic Name: 5-(4-chlorophenyl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]isoxazole-3-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-isoxazolecarboxamide IUPAC Name: 5-(4-chlorophenyl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]isoxazole-3-carboxamide Formula: C22H24ClN4O2+ MolecularWeight: 411.90456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H23ClN4O2/c1-15-13-18(27-11-9-26(2)10-12-27)7-8-19(15)24-22(28)20-14-21(29-25-20)16-3-5-17(23)6-4-16/h3-8,13-14H,9-12H2,1-2H3,(H,24,28)/p+1