N-[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]-2-(3-bromanyl-1-adamantyl)ethanamide

Systemtic Name: N-[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]-2-(3-bromanyl-1-adamantyl)ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[3-(difluoromethoxy)-4-methoxy-phenyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[3-(difluoromethoxy)-4-methoxyphenyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-[3-(difluoromethoxy)-4-methoxyphenyl]acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-[3-(difluoromethoxy)-4-methoxy-phenyl]acetamide Formula: C20H24BrF2NO3 MolecularWeight: 444.310266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br)OC(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br)OC(F)F

InChI

InChI=1S/C20H24BrF2NO3/c1-26-15-3-2-14(5-16(15)27-18(22)23)24-17(25)10-19-6-12-4-13(7-19)9-20(21,8-12)11-19/h2-3,5,12-13,18H,4,6-11H2,1H3,(H,24,25)