(3-ethyl-5-methyl-1,2-oxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (3-ethyl-5-methyl-isoxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (3-ethyl-5-methyl-4-isoxazolyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (3-ethyl-5-methyl-isoxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C12H20N3O2+ MolecularWeight: 238.3061

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)N2CC[NH+](CC2)C)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)N2CC[NH+](CC2)C)C

InChI

InChI=1S/C12H19N3O2/c1-4-10-11(9(2)17-13-10)12(16)15-7-5-14(3)6-8-15/h4-8H2,1-3H3/p+1