N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-[(2-morpholinosulfonylphenyl)methyl]-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-nitro-4-(trifluoromethyl)aniline Traditional Name: (2-morpholinosulfonylbenzyl)-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C18H18F3N3O5S MolecularWeight: 445.41283

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18F3N3O5S/c19-18(20,21)14-5-6-15(16(11-14)24(25)26)22-12-13-3-1-2-4-17(13)30(27,28)23-7-9-29-10-8-23/h1-6,11,22H,7-10,12H2