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

Systemtic Name: ethyl 7-(4-chlorophenyl)-2-(4-methylphenyl)sulfonyl-heptanoate Openeye Name: ethyl 7-(4-chlorophenyl)-2-(p-tolylsulfonyl)heptanoate CAS Name: 7-(4-chlorophenyl)-2-(4-methylphenyl)sulfonylheptanoic acid ethyl ester IUPAC Name: ethyl 7-(4-chlorophenyl)-2-(4-methylphenyl)sulfonylheptanoate Traditional Name: 7-(4-chlorophenyl)-2-tosyl-enanthic acid ethyl ester Formula: C22H27ClO4S MolecularWeight: 422.96538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClO4S/c1-3-27-22(24)21(28(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