methyl 2-fluoranyl-5-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoylamino]benzoate

Systemtic Name: methyl 2-fluoranyl-5-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoylamino]benzoate Openeye Name: methyl 2-fluoro-5-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoylamino]benzoate CAS Name: 2-fluoro-5-[[1-oxo-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-5-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoylamino]benzoate Traditional Name: 2-fluoro-5-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoylamino]benzoic acid methyl ester Formula: C20H18FN3O4 MolecularWeight: 383.373023

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC(=O)CCCC2=NC(=NO2)C3=CC=CC=C3)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC(=O)CCCC2=NC(=NO2)C3=CC=CC=C3)F

InChI

InChI=1S/C20H18FN3O4/c1-27-20(26)15-12-14(10-11-16(15)21)22-17(25)8-5-9-18-23-19(24-28-18)13-6-3-2-4-7-13/h2-4,6-7,10-12H,5,8-9H2,1H3,(H,22,25)