[4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]methyl-cyclopropyl-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium

Systemtic Name: [4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]methyl-cyclopropyl-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium Openeye Name: (2-anilino-2-oxo-ethyl)-cyclopropyl-[[4-(difluoromethoxy)-3-ethoxy-phenyl]methyl]ammonium CAS Name: (2-anilino-2-oxoethyl)-cyclopropyl-[[4-(difluoromethoxy)-3-ethoxyphenyl]methyl]ammonium IUPAC Name: (2-anilino-2-oxoethyl)-cyclopropyl-[[4-(difluoromethoxy)-3-ethoxyphenyl]methyl]azanium Traditional Name: (2-anilino-2-keto-ethyl)-cyclopropyl-[4-(difluoromethoxy)-3-ethoxy-benzyl]ammonium Formula: C21H25F2N2O3+ MolecularWeight: 391.431606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+](CC(=O)NC2=CC=CC=C2)C3CC3)OC(F)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+](CC(=O)NC2=CC=CC=C2)C3CC3)OC(F)F

InChI

InChI=1S/C21H24F2N2O3/c1-2-27-19-12-15(8-11-18(19)28-21(22)23)13-25(17-9-10-17)14-20(26)24-16-6-4-3-5-7-16/h3-8,11-12,17,21H,2,9-10,13-14H2,1H3,(H,24,26)/p+1