hexyl 3-(5-hexoxycarbonyl-2-oxidanyl-phenyl)sulfonyl-4-oxidanyl-benzoate

Systemtic Name: hexyl 3-(5-hexoxycarbonyl-2-oxidanyl-phenyl)sulfonyl-4-oxidanyl-benzoate Openeye Name: hexyl 3-(5-hexoxycarbonyl-2-hydroxy-phenyl)sulfonyl-4-hydroxy-benzoate CAS Name: 3-[5-[hexoxy(oxo)methyl]-2-hydroxyphenyl]sulfonyl-4-hydroxybenzoic acid hexyl ester IUPAC Name: hexyl 3-(5-hexoxycarbonyl-2-hydroxyphenyl)sulfonyl-4-hydroxybenzoate Traditional Name: 3-(5-hexoxycarbonyl-2-hydroxy-phenyl)sulfonyl-4-hydroxy-benzoic acid hexyl ester Formula: C26H34O8S MolecularWeight: 506.60836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC(=C(C=C1)O)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCCCCC)O

Isomeric SMILES

CCCCCCOC(=O)C1=CC(=C(C=C1)O)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCCCCC)O

InChI

InChI=1S/C26H34O8S/c1-3-5-7-9-15-33-25(29)19-11-13-21(27)23(17-19)35(31,32)24-18-20(12-14-22(24)28)26(30)34-16-10-8-6-4-2/h11-14,17-18,27-28H,3-10,15-16H2,1-2H3