5-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]-N-(3-phenylpropyl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]-N-(3-phenylpropyl)-1,2-oxazole-3-carboxamide Openeye Name: 5-[(2-chloro-4-fluoro-phenoxy)methyl]-N-(3-phenylpropyl)isoxazole-3-carboxamide CAS Name: 5-[(2-chloro-4-fluorophenoxy)methyl]-N-(3-phenylpropyl)-3-isoxazolecarboxamide IUPAC Name: 5-[(2-chloro-4-fluorophenoxy)methyl]-N-(3-phenylpropyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-[(2-chloro-4-fluoro-phenoxy)methyl]-N-(3-phenylpropyl)isoxazole-3-carboxamide Formula: C20H18ClFN2O3 MolecularWeight: 388.819923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)C2=NOC(=C2)COC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)C2=NOC(=C2)COC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C20H18ClFN2O3/c21-17-11-15(22)8-9-19(17)26-13-16-12-18(24-27-16)20(25)23-10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12H,4,7,10,13H2,(H,23,25)