N-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]piperazin-4-ium-1-carboxamide Openeye Name: N-[3-(2-chlorophenyl)-5-methyl-isoxazol-4-yl]piperazin-4-ium-1-carboxamide CAS Name: N-[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]piperazin-4-ium-1-carboxamide Traditional Name: N-[3-(2-chlorophenyl)-5-methyl-isoxazol-4-yl]piperazin-4-ium-1-carboxamide Formula: C15H18ClN4O2+ MolecularWeight: 321.78202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)NC(=O)N3CC[NH2+]CC3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)NC(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C15H17ClN4O2/c1-10-13(18-15(21)20-8-6-17-7-9-20)14(19-22-10)11-4-2-3-5-12(11)16/h2-5,17H,6-9H2,1H3,(H,18,21)/p+1