ethyl 5-(4-chlorophenyl)-2-methyl-2-(4-methylphenyl)sulfonyl-heptanoate

Systemtic Name: ethyl 5-(4-chlorophenyl)-2-methyl-2-(4-methylphenyl)sulfonyl-heptanoate Openeye Name: ethyl 5-(4-chlorophenyl)-2-methyl-2-(p-tolylsulfonyl)heptanoate CAS Name: 5-(4-chlorophenyl)-2-methyl-2-(4-methylphenyl)sulfonylheptanoic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-2-methyl-2-(4-methylphenyl)sulfonylheptanoate Traditional Name: 5-(4-chlorophenyl)-2-methyl-2-tosyl-enanthic acid ethyl ester Formula: C23H29ClO4S MolecularWeight: 436.99196

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C)(C(=O)OCC)S(=O)(=O)C1=CC=C(C=C1)C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(CCC(C)(C(=O)OCC)S(=O)(=O)C1=CC=C(C=C1)C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C23H29ClO4S/c1-5-18(19-9-11-20(24)12-10-19)15-16-23(4,22(25)28-6-2)29(26,27)21-13-7-17(3)8-14-21/h7-14,18H,5-6,15-16H2,1-4H3