N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-5-morpholin-4-yl-2-nitro-benzamide

Systemtic Name: N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-5-morpholin-4-yl-2-nitro-benzamide Openeye Name: N-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]-5-morpholino-2-nitro-benzamide CAS Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-5-(4-morpholinyl)-2-nitrobenzamide IUPAC Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-5-morpholin-4-yl-2-nitrobenzamide Traditional Name: N-[4-(difluoromethoxy)-3-methoxy-benzyl]-5-morpholino-2-nitro-benzamide Formula: C20H21F2N3O6 MolecularWeight: 437.394046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)C2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)C2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C20H21F2N3O6/c1-29-18-10-13(2-5-17(18)31-20(21)22)12-23-19(26)15-11-14(3-4-16(15)25(27)28)24-6-8-30-9-7-24/h2-5,10-11,20H,6-9,12H2,1H3,(H,23,26)