3-nitro-4-[3-(trifluoromethyl)phenyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[3-(trifluoromethyl)phenyl]thio]benzamide IUPAC Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]sulfanylbenzamide Traditional Name: 3-nitro-4-[[3-(trifluoromethyl)phenyl]thio]benzamide Formula: C14H9F3N2O3S MolecularWeight: 342.29307

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C14H9F3N2O3S/c15-14(16,17)9-2-1-3-10(7-9)23-12-5-4-8(13(18)20)6-11(12)19(21)22/h1-7H,(H2,18,20)