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

Systemtic Name: 1-[(3R)-1-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-3-methyl-butan-1-one Openeye Name: 1-[(3R)-1-[[2-(3-furyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-3-methyl-butan-1-one CAS Name: 1-[(3R)-1-[[2-(3-furanyl)-5-methyl-4-oxazolyl]methyl]-3-piperidin-1-iumyl]-3-methyl-1-butanone IUPAC Name: 1-[(3R)-1-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-3-methylbutan-1-one Traditional Name: 1-[(3R)-1-[[2-(3-furyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-3-yl]-3-methyl-butan-1-one Formula: C19H27N2O3+ MolecularWeight: 331.42928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(N=C(O1)C2=COC=C2)C[NH+]3CCC[C@H](C3)C(=O)CC(C)C

InChI

InChI=1S/C19H26N2O3/c1-13(2)9-18(22)15-5-4-7-21(10-15)11-17-14(3)24-19(20-17)16-6-8-23-12-16/h6,8,12-13,15H,4-5,7,9-11H2,1-3H3/p+1/t15-/m1/s1