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

Systemtic Name: 4-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-3,3-dimethyl-piperazin-4-ium-2-one Openeye Name: 4-[[2-(3-furyl)-5-methyl-oxazol-4-yl]methyl]-3,3-dimethyl-piperazin-4-ium-2-one CAS Name: 4-[[2-(3-furanyl)-5-methyl-4-oxazolyl]methyl]-3,3-dimethyl-2-piperazin-4-iumone IUPAC Name: 4-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-3,3-dimethylpiperazin-4-ium-2-one Traditional Name: 4-[[2-(3-furyl)-5-methyl-oxazol-4-yl]methyl]-3,3-dimethyl-piperazin-4-ium-2-one Formula: C15H20N3O3+ MolecularWeight: 290.3376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=COC=C2)C[NH+]3CCNC(=O)C3(C)C

Isomeric SMILES

CC1=C(N=C(O1)C2=COC=C2)C[NH+]3CCNC(=O)C3(C)C

InChI

InChI=1S/C15H19N3O3/c1-10-12(17-13(21-10)11-4-7-20-9-11)8-18-6-5-16-14(19)15(18,2)3/h4,7,9H,5-6,8H2,1-3H3,(H,16,19)/p+1