N-[3-(4-bromophenyl)-1,2-oxazol-5-yl]-3,5,6-trimethyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-(4-bromophenyl)-1,2-oxazol-5-yl]-3,5,6-trimethyl-1-benzofuran-2-carboxamide Openeye Name: N-[3-(4-bromophenyl)isoxazol-5-yl]-3,5,6-trimethyl-benzofuran-2-carboxamide CAS Name: N-[3-(4-bromophenyl)-5-isoxazolyl]-3,5,6-trimethyl-2-benzofurancarboxamide IUPAC Name: N-[3-(4-bromophenyl)-1,2-oxazol-5-yl]-3,5,6-trimethyl-1-benzofuran-2-carboxamide Traditional Name: N-[3-(4-bromophenyl)isoxazol-5-yl]-3,5,6-trimethyl-coumarilamide Formula: C21H17BrN2O3 MolecularWeight: 425.27528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(O2)C(=O)NC3=CC(=NO3)C4=CC=C(C=C4)Br)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(O2)C(=O)NC3=CC(=NO3)C4=CC=C(C=C4)Br)C)C

InChI

InChI=1S/C21H17BrN2O3/c1-11-8-16-13(3)20(26-18(16)9-12(11)2)21(25)23-19-10-17(24-27-19)14-4-6-15(22)7-5-14/h4-10H,1-3H3,(H,23,25)