N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-[3-(p-tolyl)isoxazol-5-yl]acetamide CAS Name: N-[3-(4-methylphenyl)-5-isoxazolyl]-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-[3-(p-tolyl)isoxazol-5-yl]acetamide Formula: C22H25N4O2+ MolecularWeight: 377.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O2/c1-17-7-9-18(10-8-17)20-15-22(28-24-20)23-21(27)16-25-11-13-26(14-12-25)19-5-3-2-4-6-19/h2-10,15H,11-14,16H2,1H3,(H,23,27)/p+1