6-pentoxyheptyl 4-methylbenzenesulfonate

Systemtic Name: 6-pentoxyheptyl 4-methylbenzenesulfonate Openeye Name: 6-pentoxyheptyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 6-pentoxyheptyl ester IUPAC Name: 6-pentoxyheptyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 6-amoxyheptyl ester Formula: C19H32O4S MolecularWeight: 356.51998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32O4S/c1-4-5-8-15-22-18(3)10-7-6-9-16-23-24(20,21)19-13-11-17(2)12-14-19/h11-14,18H,4-10,15-16H2,1-3H3