4-[4-[4-pentoxy-2-(phenylsulfonyl)phenoxy]phenyl]sulfonylphenol

Systemtic Name: 4-[4-[4-pentoxy-2-(phenylsulfonyl)phenoxy]phenyl]sulfonylphenol Openeye Name: 4-[4-[2-(benzenesulfonyl)-4-pentoxy-phenoxy]phenyl]sulfonylphenol CAS Name: 4-[4-[2-(benzenesulfonyl)-4-pentoxyphenoxy]phenyl]sulfonylphenol IUPAC Name: 4-[4-[2-(benzenesulfonyl)-4-pentoxyphenoxy]phenyl]sulfonylphenol Traditional Name: 4-[4-(4-amoxy-2-besyl-phenoxy)phenyl]sulfonylphenol Formula: C29H28O7S2 MolecularWeight: 552.65842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC(=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCCOC1=CC(=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H28O7S2/c1-2-3-7-20-35-24-14-19-28(29(21-24)38(33,34)25-8-5-4-6-9-25)36-23-12-17-27(18-13-23)37(31,32)26-15-10-22(30)11-16-26/h4-6,8-19,21,30H,2-3,7,20H2,1H3