4-[4-(3-ethynyl-5-methyl-phenoxy)phenyl]sulfonylphenol

Systemtic Name: 4-[4-(3-ethynyl-5-methyl-phenoxy)phenyl]sulfonylphenol Openeye Name: 4-[4-(3-ethynyl-5-methyl-phenoxy)phenyl]sulfonylphenol CAS Name: 4-[4-(3-ethynyl-5-methylphenoxy)phenyl]sulfonylphenol IUPAC Name: 4-[4-(3-ethynyl-5-methylphenoxy)phenyl]sulfonylphenol Traditional Name: 4-[4-(3-ethynyl-5-methyl-phenoxy)phenyl]sulfonylphenol Formula: C21H16O4S MolecularWeight: 364.41434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C#C)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O

Isomeric SMILES

CC1=CC(=CC(=C1)C#C)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H16O4S/c1-3-16-12-15(2)13-19(14-16)25-18-6-10-21(11-7-18)26(23,24)20-8-4-17(22)5-9-20/h1,4-14,22H,2H3