(2-nitrophenyl) 4-propan-2-ylbenzenesulfonate

Systemtic Name: (2-nitrophenyl) 4-propan-2-ylbenzenesulfonate Openeye Name: (2-nitrophenyl) 4-isopropylbenzenesulfonate CAS Name: 4-propan-2-ylbenzenesulfonic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 4-propan-2-ylbenzenesulfonate Traditional Name: 4-isopropylbenzenesulfonic acid (2-nitrophenyl) ester Formula: C15H15NO5S MolecularWeight: 321.3483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H15NO5S/c1-11(2)12-7-9-13(10-8-12)22(19,20)21-15-6-4-3-5-14(15)16(17)18/h3-11H,1-2H3