(3-ethyl-2-oxidanylidene-heptyl) 2,3,4,6-tetramethylbenzenesulfonate

Systemtic Name: (3-ethyl-2-oxidanylidene-heptyl) 2,3,4,6-tetramethylbenzenesulfonate Openeye Name: (3-ethyl-2-oxo-heptyl) 2,3,4,6-tetramethylbenzenesulfonate CAS Name: 2,3,4,6-tetramethylbenzenesulfonic acid (3-ethyl-2-oxoheptyl) ester IUPAC Name: (3-ethyl-2-oxoheptyl) 2,3,4,6-tetramethylbenzenesulfonate Traditional Name: 2,3,4,6-tetramethylbenzenesulfonic acid (3-ethyl-2-keto-heptyl) ester Formula: C19H30O4S MolecularWeight: 354.5041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)COS(=O)(=O)C1=C(C=C(C(=C1C)C)C)C

Isomeric SMILES

CCCCC(CC)C(=O)COS(=O)(=O)C1=C(C=C(C(=C1C)C)C)C

InChI

InChI=1S/C19H30O4S/c1-7-9-10-17(8-2)18(20)12-23-24(21,22)19-14(4)11-13(3)15(5)16(19)6/h11,17H,7-10,12H2,1-6H3