4-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]piperazin-4-ium-2-one

Systemtic Name: 4-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]piperazin-4-ium-2-one Openeye Name: 4-[[5-(2-furyl)isoxazol-3-yl]methyl]piperazin-4-ium-2-one CAS Name: 4-[[5-(2-furanyl)-3-isoxazolyl]methyl]-2-piperazin-4-iumone IUPAC Name: 4-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]piperazin-4-ium-2-one Traditional Name: 4-[[5-(2-furyl)isoxazol-3-yl]methyl]piperazin-4-ium-2-one Formula: C12H14N3O3+ MolecularWeight: 248.25786

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC2=NOC(=C2)C3=CC=CO3

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC2=NOC(=C2)C3=CC=CO3

InChI

InChI=1S/C12H13N3O3/c16-12-8-15(4-3-13-12)7-9-6-11(18-14-9)10-2-1-5-17-10/h1-2,5-6H,3-4,7-8H2,(H,13,16)/p+1