3-(1-adamantylcarbonylamino)-N-[3,4-bis(fluoranyl)phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(1-adamantylcarbonylamino)-N-[3,4-bis(fluoranyl)phenyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(adamantane-1-carbonylamino)-N-(3,4-difluorophenyl)benzofuran-2-carboxamide CAS Name: 3-[[1-adamantyl(oxo)methyl]amino]-N-(3,4-difluorophenyl)-2-benzofurancarboxamide IUPAC Name: 3-(adamantane-1-carbonylamino)-N-(3,4-difluorophenyl)-1-benzofuran-2-carboxamide Traditional Name: 3-(adamantane-1-carbonylamino)-N-(3,4-difluorophenyl)coumarilamide Formula: C26H24F2N2O3 MolecularWeight: 450.477166

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C(OC5=CC=CC=C54)C(=O)NC6=CC(=C(C=C6)F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C(OC5=CC=CC=C54)C(=O)NC6=CC(=C(C=C6)F)F

InChI

InChI=1S/C26H24F2N2O3/c27-19-6-5-17(10-20(19)28)29-24(31)23-22(18-3-1-2-4-21(18)33-23)30-25(32)26-11-14-7-15(12-26)9-16(8-14)13-26/h1-6,10,14-16H,7-9,11-13H2,(H,29,31)(H,30,32)