N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: [4-(difluoromethoxy)-3-methoxy-benzyl]-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C20H23F2N3O6S MolecularWeight: 471.474926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C20H23F2N3O6S/c1-30-19-11-14(5-8-18(19)31-20(21)22)13-23-16-7-6-15(12-17(16)25(26)27)32(28,29)24-9-3-2-4-10-24/h5-8,11-12,20,23H,2-4,9-10,13H2,1H3