ethanedioic acid; 5-[3-(fluoranylmethyl)-1-methyl-pyrrolidin-2-yl]-3-methyl-1,2-oxazole

Systemtic Name: ethanedioic acid; 5-[3-(fluoranylmethyl)-1-methyl-pyrrolidin-2-yl]-3-methyl-1,2-oxazole Openeye Name: 5-[3-(fluoromethyl)-1-methyl-pyrrolidin-2-yl]-3-methyl-isoxazole; oxalic acid CAS Name: 5-[3-(fluoromethyl)-1-methyl-2-pyrrolidinyl]-3-methylisoxazole; oxalic acid IUPAC Name: 5-[3-(fluoromethyl)-1-methylpyrrolidin-2-yl]-3-methyl-1,2-oxazole; oxalic acid Traditional Name: 5-[3-(fluoromethyl)-1-methyl-pyrrolidin-2-yl]-3-methyl-isoxazole; oxalic acid Formula: C12H17FN2O5 MolecularWeight: 288.272183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2C(CCN2C)CF.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=NOC(=C1)C2C(CCN2C)CF.C(=O)(C(=O)O)O

InChI

InChI=1S/C10H15FN2O.C2H2O4/c1-7-5-9(14-12-7)10-8(6-11)3-4-13(10)2;3-1(4)2(5)6/h5,8,10H,3-4,6H2,1-2H3;(H,3,4)(H,5,6)