N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-3-nitro-benzamide

Systemtic Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-3-nitro-benzamide Openeye Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-3-nitro-benzamide CAS Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-3-nitrobenzamide Traditional Name: N-[2-(ethylamino)-5-triflyl-phenyl]-3-nitro-benzamide Formula: C16H14F3N3O5S MolecularWeight: 417.35967

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)S(=O)(=O)C(F)(F)F)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)S(=O)(=O)C(F)(F)F)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H14F3N3O5S/c1-2-20-13-7-6-12(28(26,27)16(17,18)19)9-14(13)21-15(23)10-4-3-5-11(8-10)22(24)25/h3-9,20H,2H2,1H3,(H,21,23)