3,6-dimethyloctan-3-yl 3,4,5-tris(oxidanyl)benzoate

Systemtic Name: 3,6-dimethyloctan-3-yl 3,4,5-tris(oxidanyl)benzoate Openeye Name: (1-ethyl-1,4-dimethyl-hexyl) 3,4,5-trihydroxybenzoate CAS Name: 3,4,5-trihydroxybenzoic acid 3,6-dimethyloctan-3-yl ester IUPAC Name: 3,6-dimethyloctan-3-yl 3,4,5-trihydroxybenzoate Traditional Name: 3,4,5-trihydroxybenzoic acid (1-ethyl-1,4-dimethyl-hexyl) ester Formula: C17H26O5 MolecularWeight: 310.38534

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCC(C)(CC)OC(=O)C1=CC(=C(C(=C1)O)O)O

Isomeric SMILES

CCC(C)CCC(C)(CC)OC(=O)C1=CC(=C(C(=C1)O)O)O

InChI

InChI=1S/C17H26O5/c1-5-11(3)7-8-17(4,6-2)22-16(21)12-9-13(18)15(20)14(19)10-12/h9-11,18-20H,5-8H2,1-4H3