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

Systemtic Name: 3-ethyl-5-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-ethyl-5-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]isoxazole-4-carboxamide CAS Name: 3-ethyl-5-methyl-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-4-isoxazolecarboxamide IUPAC Name: 3-ethyl-5-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-1,2-oxazole-4-carboxamide Traditional Name: 3-ethyl-5-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]isoxazole-4-carboxamide Formula: C19H27N4O2+ MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)NCC[NH+]2CCN(CC2)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)NCC[NH+]2CCN(CC2)C3=CC=CC=C3)C

InChI

InChI=1S/C19H26N4O2/c1-3-17-18(15(2)25-21-17)19(24)20-9-10-22-11-13-23(14-12-22)16-7-5-4-6-8-16/h4-8H,3,9-14H2,1-2H3,(H,20,24)/p+1