(4-methyl-2-oxidanylidene-pentyl) 4-ethoxybenzenesulfonate

Systemtic Name: (4-methyl-2-oxidanylidene-pentyl) 4-ethoxybenzenesulfonate Openeye Name: (4-methyl-2-oxo-pentyl) 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid (4-methyl-2-oxopentyl) ester IUPAC Name: (4-methyl-2-oxopentyl) 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid (2-keto-4-methyl-pentyl) ester Formula: C14H20O5S MolecularWeight: 300.3706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)OCC(=O)CC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)OCC(=O)CC(C)C

InChI

InChI=1S/C14H20O5S/c1-4-18-13-5-7-14(8-6-13)20(16,17)19-10-12(15)9-11(2)3/h5-8,11H,4,9-10H2,1-3H3