1,4,7,10-tetraoxacyclotridec-12-ylmethyl 4-methylbenzenesulfonate

Systemtic Name: 1,4,7,10-tetraoxacyclotridec-12-ylmethyl 4-methylbenzenesulfonate Openeye Name: 1,4,7,10-tetraoxacyclotridec-12-ylmethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1,4,7,10-tetraoxacyclotridec-12-ylmethyl ester IUPAC Name: 1,4,7,10-tetraoxacyclotridec-12-ylmethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1,4,7,10-tetraoxacyclotridec-12-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)OCC2COCCOCCOCCOC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2COCCOCCOCCOC2

InChI

InChI=1S/C17H26O7S/c1-15-2-4-17(5-3-15)25(18,19)24-14-16-12-22-10-8-20-6-7-21-9-11-23-13-16/h2-5,16H,6-14H2,1H3