methyl 5-decyl-2-(1,4,7,10-tetraoxacyclotridec-5-ylmethoxy)benzoate

Systemtic Name: methyl 5-decyl-2-(1,4,7,10-tetraoxacyclotridec-5-ylmethoxy)benzoate Openeye Name: methyl 5-decyl-2-(1,4,7,10-tetraoxacyclotridec-5-ylmethoxy)benzoate CAS Name: 5-decyl-2-(1,4,7,10-tetraoxacyclotridec-5-ylmethoxy)benzoic acid methyl ester IUPAC Name: methyl 5-decyl-2-(1,4,7,10-tetraoxacyclotridec-5-ylmethoxy)benzoate Traditional Name: 5-decyl-2-(1,4,7,10-tetraoxacyclotridec-5-ylmethoxy)benzoic acid methyl ester Formula: C28H46O7 MolecularWeight: 494.66064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(C=C1)OCC2COCCOCCCOCCO2)C(=O)OC

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(C=C1)OCC2COCCOCCCOCCO2)C(=O)OC

InChI

InChI=1S/C28H46O7/c1-3-4-5-6-7-8-9-10-12-24-13-14-27(26(21-24)28(29)30-2)35-23-25-22-33-18-17-31-15-11-16-32-19-20-34-25/h13-14,21,25H,3-12,15-20,22-23H2,1-2H3