ethyl 7-(4-chlorophenyl)-2-(4-methylphenyl)sulfonyloxy-heptanoate

Systemtic Name: ethyl 7-(4-chlorophenyl)-2-(4-methylphenyl)sulfonyloxy-heptanoate Openeye Name: ethyl 7-(4-chlorophenyl)-2-(p-tolylsulfonyloxy)heptanoate CAS Name: 7-(4-chlorophenyl)-2-(4-methylphenyl)sulfonyloxyheptanoic acid ethyl ester IUPAC Name: ethyl 7-(4-chlorophenyl)-2-(4-methylphenyl)sulfonyloxyheptanoate Traditional Name: 7-(4-chlorophenyl)-2-tosyloxy-enanthic acid ethyl ester Formula: C22H27ClO5S MolecularWeight: 438.96478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCC1=CC=C(C=C1)Cl)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C(CCCCCC1=CC=C(C=C1)Cl)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H27ClO5S/c1-3-27-22(24)21(28-29(25,26)20-15-9-17(2)10-16-20)8-6-4-5-7-18-11-13-19(23)14-12-18/h9-16,21H,3-8H2,1-2H3