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

Systemtic Name: ethyl 7-(4-chlorophenyl)-2-(4-ethanoylphenyl)sulfonyl-heptanoate Openeye Name: ethyl 2-(4-acetylphenyl)sulfonyl-7-(4-chlorophenyl)heptanoate CAS Name: 2-(4-acetylphenyl)sulfonyl-7-(4-chlorophenyl)heptanoic acid ethyl ester IUPAC Name: ethyl 2-(4-acetylphenyl)sulfonyl-7-(4-chlorophenyl)heptanoate Traditional Name: 2-(4-acetylphenyl)sulfonyl-7-(4-chlorophenyl)enanthic acid ethyl ester Formula: C23H27ClO5S MolecularWeight: 450.97548

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(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C23H27ClO5S/c1-3-29-23(26)22(8-6-4-5-7-18-9-13-20(24)14-10-18)30(27,28)21-15-11-19(12-16-21)17(2)25/h9-16,22H,3-8H2,1-2H3