N-(3,4-dihydro-2H-chromen-4-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(3,4-dihydro-2H-chromen-4-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-chroman-4-yl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-(3,4-dihydro-2H-1-benzopyran-4-yl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(3,4-dihydro-2H-chromen-4-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-chroman-4-yl-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide Formula: C18H15F3N2O4S MolecularWeight: 412.38291

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)CSC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1COC2=CC=CC=C2C1NC(=O)CSC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H15F3N2O4S/c19-18(20,21)11-5-6-16(14(9-11)23(25)26)28-10-17(24)22-13-7-8-27-15-4-2-1-3-12(13)15/h1-6,9,13H,7-8,10H2,(H,22,24)