3-nitro-4-oxidanyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 3-nitro-4-oxidanyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: 4-hydroxy-3-nitro-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 4-hydroxy-3-nitro-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 4-hydroxy-3-nitro-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: 4-hydroxy-3-nitro-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C16H15F3N2O6S MolecularWeight: 420.36031

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(F)(F)F)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(F)(F)F)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C16H15F3N2O6S/c1-2-7-27-15-6-3-10(16(17,18)19)8-12(15)20-28(25,26)11-4-5-14(22)13(9-11)21(23)24/h3-6,8-9,20,22H,2,7H2,1H3