2-(4-methylphenyl)sulfinyl-5-(oxan-2-yloxy)-3-oxidanyl-5-(4-phenoxyphenyl)pentanoate

Systemtic Name: 2-(4-methylphenyl)sulfinyl-5-(oxan-2-yloxy)-3-oxidanyl-5-(4-phenoxyphenyl)pentanoate Openeye Name: 3-hydroxy-5-(4-phenoxyphenyl)-2-(p-tolylsulfinyl)-5-tetrahydropyran-2-yloxy-pentanoate CAS Name: 3-hydroxy-2-(4-methylphenyl)sulfinyl-5-(2-oxanyloxy)-5-(4-phenoxyphenyl)pentanoate IUPAC Name: 3-hydroxy-2-(4-methylphenyl)sulfinyl-5-(oxan-2-yloxy)-5-(4-phenoxyphenyl)pentanoate Traditional Name: 3-hydroxy-5-(4-phenoxyphenyl)-2-(p-tolylsulfinyl)-5-tetrahydropyran-2-yloxy-valerate Formula: C29H31O7S- MolecularWeight: 523.61724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(C(CC(C2=CC=C(C=C2)OC3=CC=CC=C3)OC4CCCCO4)O)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)C(C(CC(C2=CC=C(C=C2)OC3=CC=CC=C3)OC4CCCCO4)O)C(=O)[O-]

InChI

InChI=1S/C29H32O7S/c1-20-10-16-24(17-11-20)37(33)28(29(31)32)25(30)19-26(36-27-9-5-6-18-34-27)21-12-14-23(15-13-21)35-22-7-3-2-4-8-22/h2-4,7-8,10-17,25-28,30H,5-6,9,18-19H2,1H3,(H,31,32)/p-1