N-[4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]-2-(4-bromanylpyrazol-1-yl)butanamide

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]-2-(4-bromanylpyrazol-1-yl)butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[4-(difluoromethoxy)-3-ethoxy-phenyl]butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[4-(difluoromethoxy)-3-ethoxyphenyl]butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[4-(difluoromethoxy)-3-ethoxyphenyl]butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[4-(difluoromethoxy)-3-ethoxy-phenyl]butyramide Formula: C16H18BrF2N3O3 MolecularWeight: 418.233226

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1)OC(F)F)OCC)N2C=C(C=N2)Br

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1)OC(F)F)OCC)N2C=C(C=N2)Br

InChI

InChI=1S/C16H18BrF2N3O3/c1-3-12(22-9-10(17)8-20-22)15(23)21-11-5-6-13(25-16(18)19)14(7-11)24-4-2/h5-9,12,16H,3-4H2,1-2H3,(H,21,23)