[4-[bis(fluoranyl)methoxy]phenyl]methyl-[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [4-[bis(fluoranyl)methoxy]phenyl]methyl-[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl]-[[4-(difluoromethoxy)phenyl]methyl]-methyl-ammonium CAS Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-[[4-(difluoromethoxy)phenyl]methyl]-methylammonium IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-[[4-(difluoromethoxy)phenyl]methyl]-methylazanium Traditional Name: [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl]-[4-(difluoromethoxy)benzyl]-methyl-ammonium Formula: C17H22F2N3O2+ MolecularWeight: 338.372286

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OC(F)F)CC(=O)NC2(CCCC2)C#N

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OC(F)F)CC(=O)NC2(CCCC2)C#N

InChI

InChI=1S/C17H21F2N3O2/c1-22(10-13-4-6-14(7-5-13)24-16(18)19)11-15(23)21-17(12-20)8-2-3-9-17/h4-7,16H,2-3,8-11H2,1H3,(H,21,23)/p+1