(phenylmethyl) 2-(4-nitrophenyl)sulfonylbenzoate

Systemtic Name: (phenylmethyl) 2-(4-nitrophenyl)sulfonylbenzoate Openeye Name: benzyl 2-(4-nitrophenyl)sulfonylbenzoate CAS Name: 2-(4-nitrophenyl)sulfonylbenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(4-nitrophenyl)sulfonylbenzoate Traditional Name: 2-nosylbenzoic acid benzyl ester Formula: C20H15NO6S MolecularWeight: 397.4012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H15NO6S/c22-20(27-14-15-6-2-1-3-7-15)18-8-4-5-9-19(18)28(25,26)17-12-10-16(11-13-17)21(23)24/h1-13H,14H2