1,4,7,10-tetraoxacyclotridec-5-ylmethyl 4-methylbenzenesulfonate

Systemtic Name: 1,4,7,10-tetraoxacyclotridec-5-ylmethyl 4-methylbenzenesulfonate Openeye Name: 1,4,7,10-tetraoxacyclotridec-5-ylmethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1,4,7,10-tetraoxacyclotridec-5-ylmethyl ester IUPAC Name: 1,4,7,10-tetraoxacyclotridec-5-ylmethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1,4,7,10-tetraoxacyclotridec-5-ylmethyl ester Formula: C17H26O7S MolecularWeight: 374.44914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2COCCOCCCOCCO2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2COCCOCCCOCCO2

InChI

InChI=1S/C17H26O7S/c1-15-3-5-17(6-4-15)25(18,19)24-14-16-13-22-10-9-20-7-2-8-21-11-12-23-16/h3-6,16H,2,7-14H2,1H3