6-[[4-(hexadecoxymethyl)oxolan-2-yl]methoxy]hexyl 4-methylbenzenesulfonate

Systemtic Name: 6-[[4-(hexadecoxymethyl)oxolan-2-yl]methoxy]hexyl 4-methylbenzenesulfonate Openeye Name: 6-[[4-(hexadecoxymethyl)tetrahydrofuran-2-yl]methoxy]hexyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 6-[[4-(hexadecoxymethyl)-2-oxolanyl]methoxy]hexyl ester IUPAC Name: 6-[[4-(hexadecoxymethyl)oxolan-2-yl]methoxy]hexyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 6-[[4-(cetyloxymethyl)tetrahydrofuran-2-yl]methoxy]hexyl ester Formula: C35H62O6S MolecularWeight: 610.92818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC1CC(OC1)COCCCCCCOS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC1CC(OC1)COCCCCCCOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C35H62O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-25-38-29-33-28-34(40-30-33)31-39-26-19-16-17-20-27-41-42(36,37)35-23-21-32(2)22-24-35/h21-24,33-34H,3-20,25-31H2,1-2H3