N-[3,5-bis(trifluoromethyl)phenyl]-4-nitro-benzenesulfonamide hydrochloride

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-nitro-benzenesulfonamide hydrochloride Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-nitro-benzenesulfonamide hydrochloride CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-nitrobenzenesulfonamide hydrochloride IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-nitrobenzenesulfonamide hydrochloride Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-nitro-benzenesulfonamide hydrochloride Formula: C14H9ClF6N2O4S MolecularWeight: 450.740679

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.Cl

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.Cl

InChI

InChI=1S/C14H8F6N2O4S.ClH/c15-13(16,17)8-5-9(14(18,19)20)7-10(6-8)21-27(25,26)12-3-1-11(2-4-12)22(23)24;/h1-7,21H;1H