methyl 3-(4-methoxyphenyl)sulfonyl-2-methyl-2-oxidanyl-7-phenyl-heptanoate

Systemtic Name: methyl 3-(4-methoxyphenyl)sulfonyl-2-methyl-2-oxidanyl-7-phenyl-heptanoate Openeye Name: methyl 2-hydroxy-3-(4-methoxyphenyl)sulfonyl-2-methyl-7-phenyl-heptanoate CAS Name: 2-hydroxy-3-(4-methoxyphenyl)sulfonyl-2-methyl-7-phenylheptanoic acid methyl ester IUPAC Name: methyl 2-hydroxy-3-(4-methoxyphenyl)sulfonyl-2-methyl-7-phenylheptanoate Traditional Name: 2-hydroxy-3-(4-methoxyphenyl)sulfonyl-2-methyl-7-phenyl-enanthic acid methyl ester Formula: C22H28O6S MolecularWeight: 420.51912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCCCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC)(C(=O)OC)O

Isomeric SMILES

CC(C(CCCCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC)(C(=O)OC)O

InChI

InChI=1S/C22H28O6S/c1-22(24,21(23)28-3)20(12-8-7-11-17-9-5-4-6-10-17)29(25,26)19-15-13-18(27-2)14-16-19/h4-6,9-10,13-16,20,24H,7-8,11-12H2,1-3H3