3-[5-azanyl-3-(trifluoromethyl)-3,4-dihydro-2H-pyrrol-2-yl]-2-oxidanyl-5-propyl-2H-1,3-oxazole-4-carboxylic acid

Systemtic Name: 3-[5-azanyl-3-(trifluoromethyl)-3,4-dihydro-2H-pyrrol-2-yl]-2-oxidanyl-5-propyl-2H-1,3-oxazole-4-carboxylic acid Openeye Name: 3-[5-amino-3-(trifluoromethyl)-3,4-dihydro-2H-pyrrol-2-yl]-2-hydroxy-5-propyl-2H-oxazole-4-carboxylic acid CAS Name: 3-[5-amino-3-(trifluoromethyl)-3,4-dihydro-2H-pyrrol-2-yl]-2-hydroxy-5-propyl-2H-oxazole-4-carboxylic acid IUPAC Name: 3-[5-amino-3-(trifluoromethyl)-3,4-dihydro-2H-pyrrol-2-yl]-2-hydroxy-5-propyl-2H-1,3-oxazole-4-carboxylic acid Traditional Name: 3-[5-amino-3-(trifluoromethyl)-1-pyrrolin-2-yl]-2-hydroxy-5-propyl-4-oxazoline-4-carboxylic acid Formula: C12H16F3N3O4 MolecularWeight: 323.26835

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N(C(O1)O)C2C(CC(=N2)N)C(F)(F)F)C(=O)O

Isomeric SMILES

CCCC1=C(N(C(O1)O)C2C(CC(=N2)N)C(F)(F)F)C(=O)O

InChI

InChI=1S/C12H16F3N3O4/c1-2-3-6-8(10(19)20)18(11(21)22-6)9-5(12(13,14)15)4-7(16)17-9/h5,9,11,21H,2-4H2,1H3,(H2,16,17)(H,19,20)