2,3-dimethyl-N-[4-nitro-3-(trifluoromethylsulfanyl)phenyl]pentanamide

Systemtic Name: 2,3-dimethyl-N-[4-nitro-3-(trifluoromethylsulfanyl)phenyl]pentanamide Openeye Name: 2,3-dimethyl-N-[4-nitro-3-(trifluoromethylsulfanyl)phenyl]pentanamide CAS Name: 2,3-dimethyl-N-[4-nitro-3-(trifluoromethylthio)phenyl]pentanamide IUPAC Name: 2,3-dimethyl-N-[4-nitro-3-(trifluoromethylsulfanyl)phenyl]pentanamide Traditional Name: 2,3-dimethyl-N-[4-nitro-3-(trifluoromethylthio)phenyl]valeramide Formula: C14H17F3N2O3S MolecularWeight: 350.35659

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])SC(F)(F)F

Isomeric SMILES

CCC(C)C(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])SC(F)(F)F

InChI

InChI=1S/C14H17F3N2O3S/c1-4-8(2)9(3)13(20)18-10-5-6-11(19(21)22)12(7-10)23-14(15,16)17/h5-9H,4H2,1-3H3,(H,18,20)