propan-2-yl 2-[(R)-[2-nitro-4-(trifluoromethyl)phenyl]sulfinyl]ethanoate

Systemtic Name: propan-2-yl 2-[(R)-[2-nitro-4-(trifluoromethyl)phenyl]sulfinyl]ethanoate Openeye Name: isopropyl 2-[(R)-[2-nitro-4-(trifluoromethyl)phenyl]sulfinyl]acetate CAS Name: 2-[(R)-[2-nitro-4-(trifluoromethyl)phenyl]sulfinyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(R)-[2-nitro-4-(trifluoromethyl)phenyl]sulfinyl]acetate Traditional Name: 2-[(R)-[2-nitro-4-(trifluoromethyl)phenyl]sulfinyl]acetic acid isopropyl ester Formula: C12H12F3NO5S MolecularWeight: 339.28759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CS(=O)C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)C[S@@](=O)C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H12F3NO5S/c1-7(2)21-11(17)6-22(20)10-4-3-8(12(13,14)15)5-9(10)16(18)19/h3-5,7H,6H2,1-2H3/t22-/m1/s1