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

Systemtic Name: (3S)-1-ethyl-4-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-3-methyl-piperazin-4-ium-2-one Openeye Name: (3S)-1-ethyl-4-[[2-(3-furyl)-5-methyl-oxazol-4-yl]methyl]-3-methyl-piperazin-4-ium-2-one CAS Name: (3S)-1-ethyl-4-[[2-(3-furanyl)-5-methyl-4-oxazolyl]methyl]-3-methyl-2-piperazin-4-iumone IUPAC Name: (3S)-1-ethyl-4-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-3-methylpiperazin-4-ium-2-one Traditional Name: (3S)-1-ethyl-4-[[2-(3-furyl)-5-methyl-oxazol-4-yl]methyl]-3-methyl-piperazin-4-ium-2-one Formula: C16H22N3O3+ MolecularWeight: 304.36418

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](C(C1=O)C)CC2=C(OC(=N2)C3=COC=C3)C

Isomeric SMILES

CCN1CC[NH+]([C@H](C1=O)C)CC2=C(OC(=N2)C3=COC=C3)C

InChI

InChI=1S/C16H21N3O3/c1-4-18-6-7-19(11(2)16(18)20)9-14-12(3)22-15(17-14)13-5-8-21-10-13/h5,8,10-11H,4,6-7,9H2,1-3H3/p+1/t11-/m0/s1