(3R)-1-(3-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate

Systemtic Name: (3R)-1-(3-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate Openeye Name: (3R)-1-(3-fluoro-4-methyl-phenyl)-5-oxo-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate CAS Name: (3R)-1-(3-fluoro-4-methylphenyl)-5-oxo-N-(1H-1,2,4-triazol-5-yl)-3-pyrrolidinecarboximidate IUPAC Name: (3R)-1-(3-fluoro-4-methylphenyl)-5-oxo-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate Traditional Name: (3R)-1-(3-fluoro-4-methyl-phenyl)-5-keto-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate Formula: C14H13FN5O2- MolecularWeight: 302.283723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=NC3=NC=NN3)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@@H](CC2=O)C(=NC3=NC=NN3)[O-])F

InChI

InChI=1S/C14H14FN5O2/c1-8-2-3-10(5-11(8)15)20-6-9(4-12(20)21)13(22)18-14-16-7-17-19-14/h2-3,5,7,9H,4,6H2,1H3,(H2,16,17,18,19,22)/p-1/t9-/m1/s1