dihexyl 5-chloranylsulfonylbenzene-1,3-dicarboxylate

Systemtic Name: dihexyl 5-chloranylsulfonylbenzene-1,3-dicarboxylate Openeye Name: dihexyl 5-chlorosulfonylbenzene-1,3-dicarboxylate CAS Name: 5-chlorosulfonylbenzene-1,3-dicarboxylic acid dihexyl ester IUPAC Name: dihexyl 5-chlorosulfonylbenzene-1,3-dicarboxylate Traditional Name: 5-chlorosulfonylbenzene-1,3-dicarboxylic acid dihexyl ester Formula: C20H29ClO6S MolecularWeight: 432.95866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC(=CC(=C1)S(=O)(=O)Cl)C(=O)OCCCCCC

Isomeric SMILES

CCCCCCOC(=O)C1=CC(=CC(=C1)S(=O)(=O)Cl)C(=O)OCCCCCC

InChI

InChI=1S/C20H29ClO6S/c1-3-5-7-9-11-26-19(22)16-13-17(15-18(14-16)28(21,24)25)20(23)27-12-10-8-6-4-2/h13-15H,3-12H2,1-2H3