N-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-4-[bis(fluoranyl)methoxy]-3-methoxy-benzamide

Systemtic Name: N-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-4-[bis(fluoranyl)methoxy]-3-methoxy-benzamide Openeye Name: N-[2-(1-adamantylamino)-2-oxo-ethyl]-4-(difluoromethoxy)-3-methoxy-benzamide CAS Name: N-[2-(1-adamantylamino)-2-oxoethyl]-4-(difluoromethoxy)-3-methoxybenzamide IUPAC Name: N-[2-(1-adamantylamino)-2-oxoethyl]-4-(difluoromethoxy)-3-methoxybenzamide Traditional Name: N-[2-(1-adamantylamino)-2-keto-ethyl]-4-(difluoromethoxy)-3-methoxy-benzamide Formula: C21H26F2N2O4 MolecularWeight: 408.438946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NCC(=O)NC23CC4CC(C2)CC(C4)C3)OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NCC(=O)NC23CC4CC(C2)CC(C4)C3)OC(F)F

InChI

InChI=1S/C21H26F2N2O4/c1-28-17-7-15(2-3-16(17)29-20(22)23)19(27)24-11-18(26)25-21-8-12-4-13(9-21)6-14(5-12)10-21/h2-3,7,12-14,20H,4-6,8-11H2,1H3,(H,24,27)(H,25,26)