2-[(R)-furan-2-yl(pyrrolidin-1-ium-1-yl)methyl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-[(R)-furan-2-yl(pyrrolidin-1-ium-1-yl)methyl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: 2-[(R)-2-furyl(pyrrolidin-1-ium-1-yl)methyl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(R)-2-furanyl(1-pyrrolidin-1-iumyl)methyl]-4-methyl-5-thiazolecarboxylate IUPAC Name: 2-[(R)-furan-2-yl(pyrrolidin-1-ium-1-yl)methyl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(R)-2-furyl(pyrrolidin-1-ium-1-yl)methyl]-4-methyl-thiazole-5-carboxylate Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C(C2=CC=CO2)[NH+]3CCCC3)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)[C@@H](C2=CC=CO2)[NH+]3CCCC3)C(=O)[O-]

InChI

InChI=1S/C14H16N2O3S/c1-9-12(14(17)18)20-13(15-9)11(10-5-4-8-19-10)16-6-2-3-7-16/h4-5,8,11H,2-3,6-7H2,1H3,(H,17,18)/t11-/m1/s1