ethyl 7-(4-chlorophenyl)-2-(4-cyanophenyl)sulfonyl-heptanoate

Systemtic Name: ethyl 7-(4-chlorophenyl)-2-(4-cyanophenyl)sulfonyl-heptanoate Openeye Name: ethyl 7-(4-chlorophenyl)-2-(4-cyanophenyl)sulfonyl-heptanoate CAS Name: 7-(4-chlorophenyl)-2-(4-cyanophenyl)sulfonylheptanoic acid ethyl ester IUPAC Name: ethyl 7-(4-chlorophenyl)-2-(4-cyanophenyl)sulfonylheptanoate Traditional Name: 7-(4-chlorophenyl)-2-(4-cyanophenyl)sulfonyl-enanthic acid ethyl ester Formula: C22H24ClNO4S MolecularWeight: 433.94826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCC1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)C(CCCCCC1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H24ClNO4S/c1-2-28-22(25)21(29(26,27)20-14-10-18(16-24)11-15-20)7-5-3-4-6-17-8-12-19(23)13-9-17/h8-15,21H,2-7H2,1H3