2-morpholin-4-ylsulfonyl-4-nitro-N-[[4-(trifluoromethyloxy)phenyl]methyl]aniline

Systemtic Name: 2-morpholin-4-ylsulfonyl-4-nitro-N-[[4-(trifluoromethyloxy)phenyl]methyl]aniline Openeye Name: 2-morpholinosulfonyl-4-nitro-N-[[4-(trifluoromethoxy)phenyl]methyl]aniline CAS Name: 2-(4-morpholinylsulfonyl)-4-nitro-N-[[4-(trifluoromethoxy)phenyl]methyl]aniline IUPAC Name: 2-morpholin-4-ylsulfonyl-4-nitro-N-[[4-(trifluoromethoxy)phenyl]methyl]aniline Traditional Name: (2-morpholinosulfonyl-4-nitro-phenyl)-[4-(trifluoromethoxy)benzyl]amine Formula: C18H18F3N3O6S MolecularWeight: 461.41223

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C18H18F3N3O6S/c19-18(20,21)30-15-4-1-13(2-5-15)12-22-16-6-3-14(24(25)26)11-17(16)31(27,28)23-7-9-29-10-8-23/h1-6,11,22H,7-10,12H2