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

Systemtic Name: 2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-[5-(p-tolyl)oxazol-2-yl]benzamide CAS Name: 2-[5-(4-methylphenyl)-2-oxazolyl]-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]benzamide IUPAC Name: 2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-[5-(p-tolyl)oxazol-2-yl]benzamide Formula: C29H31N4O2+ MolecularWeight: 467.58204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC=C3C(=O)NCC[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC=C3C(=O)NCC[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N4O2/c1-22-11-13-23(14-12-22)27-21-31-29(35-27)26-10-6-5-9-25(26)28(34)30-15-16-32-17-19-33(20-18-32)24-7-3-2-4-8-24/h2-14,21H,15-20H2,1H3,(H,30,34)/p+1