3-(azepan-1-ylsulfonyl)-N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[4-fluoro-2-(trifluoromethyl)benzyl]-4-methoxy-benzamide Formula: C22H24F4N2O4S MolecularWeight: 488.495573

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2=C(C=C(C=C2)F)C(F)(F)F)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2=C(C=C(C=C2)F)C(F)(F)F)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H24F4N2O4S/c1-32-19-9-7-15(12-20(19)33(30,31)28-10-4-2-3-5-11-28)21(29)27-14-16-6-8-17(23)13-18(16)22(24,25)26/h6-9,12-13H,2-5,10-11,14H2,1H3,(H,27,29)