(2-oxidanylidene-3-propyl-heptyl) 4-ethoxybenzenesulfonate

Systemtic Name: (2-oxidanylidene-3-propyl-heptyl) 4-ethoxybenzenesulfonate Openeye Name: (2-oxo-3-propyl-heptyl) 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid (2-oxo-3-propylheptyl) ester IUPAC Name: (2-oxo-3-propylheptyl) 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid (2-keto-3-propyl-heptyl) ester Formula: C18H28O5S MolecularWeight: 356.47692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)C(=O)COS(=O)(=O)C1=CC=C(C=C1)OCC

Isomeric SMILES

CCCCC(CCC)C(=O)COS(=O)(=O)C1=CC=C(C=C1)OCC

InChI

InChI=1S/C18H28O5S/c1-4-7-9-15(8-5-2)18(19)14-23-24(20,21)17-12-10-16(11-13-17)22-6-3/h10-13,15H,4-9,14H2,1-3H3