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

Systemtic Name: N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-N-methyl-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]-N-methyl-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-N-methyl-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-N-methyl-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: [4-(difluoromethoxy)-3-methoxy-benzyl]-methyl-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C21H25F2N3O6S MolecularWeight: 485.501506

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC(F)F)OC)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC(F)F)OC)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H25F2N3O6S/c1-24(14-15-6-9-19(32-21(22)23)20(12-15)31-2)17-8-7-16(13-18(17)26(27)28)33(29,30)25-10-4-3-5-11-25/h6-9,12-13,21H,3-5,10-11,14H2,1-2H3