N-[4-(tert-butylcarbamoyl)phenyl]-3-(3-fluorophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-(3-fluorophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-(3-fluorophenyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: N-[4-[(tert-butylamino)-oxomethyl]phenyl]-3-(3-fluorophenyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-(3-fluorophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-(3-fluorophenyl)-2-isoxazoline-5-carboxamide Formula: C21H22FN3O3 MolecularWeight: 383.416083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=NO2)C3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=NO2)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H22FN3O3/c1-21(2,3)24-19(26)13-7-9-16(10-8-13)23-20(27)18-12-17(25-28-18)14-5-4-6-15(22)11-14/h4-11,18H,12H2,1-3H3,(H,23,27)(H,24,26)