4-pentoxypentyl 4-methylbenzenesulfonate

Systemtic Name: 4-pentoxypentyl 4-methylbenzenesulfonate Openeye Name: 4-pentoxypentyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-pentoxypentyl ester IUPAC Name: 4-pentoxypentyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-amoxypentyl ester Formula: C17H28O4S MolecularWeight: 328.46682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(C)CCCOS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCOC(C)CCCOS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C17H28O4S/c1-4-5-6-13-20-16(3)8-7-14-21-22(18,19)17-11-9-15(2)10-12-17/h9-12,16H,4-8,13-14H2,1-3H3