7-[[5-(octadecoxymethyl)oxolan-3-yl]methoxy]heptyl 4-methylbenzenesulfonate

Systemtic Name: 7-[[5-(octadecoxymethyl)oxolan-3-yl]methoxy]heptyl 4-methylbenzenesulfonate Openeye Name: 7-[[5-(octadecoxymethyl)tetrahydrofuran-3-yl]methoxy]heptyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 7-[[5-(octadecoxymethyl)-3-oxolanyl]methoxy]heptyl ester IUPAC Name: 7-[[5-(octadecoxymethyl)oxolan-3-yl]methoxy]heptyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 7-[[5-(stearyloxymethyl)tetrahydrofuran-3-yl]methoxy]heptyl ester Formula: C38H68O6S MolecularWeight: 653.00792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC1CC(CO1)COCCCCCCCOS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC1CC(CO1)COCCCCCCCOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C38H68O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-22-29-42-34-37-31-36(33-43-37)32-41-28-21-19-17-20-23-30-44-45(39,40)38-26-24-35(2)25-27-38/h24-27,36-37H,3-23,28-34H2,1-2H3