[2-methoxy-4-[(E)-4-(4-methylphenyl)sulfonyl-3-oxidanyl-dec-5-enyl]phenyl] 2-methylpropanoate

Systemtic Name: [2-methoxy-4-[(E)-4-(4-methylphenyl)sulfonyl-3-oxidanyl-dec-5-enyl]phenyl] 2-methylpropanoate Openeye Name: [4-[(E)-3-hydroxy-4-(p-tolylsulfonyl)dec-5-enyl]-2-methoxy-phenyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [4-[(E)-3-hydroxy-4-(4-methylphenyl)sulfonyldec-5-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-3-hydroxy-4-(4-methylphenyl)sulfonyldec-5-enyl]-2-methoxyphenyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [4-[(E)-3-hydroxy-4-tosyl-dec-5-enyl]-2-methoxy-phenyl] ester Formula: C28H38O6S MolecularWeight: 502.66272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC(C(CCC1=CC(=C(C=C1)OC(=O)C(C)C)OC)O)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC/C=C/C(C(CCC1=CC(=C(C=C1)OC(=O)C(C)C)OC)O)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C28H38O6S/c1-6-7-8-9-10-27(35(31,32)23-15-11-21(4)12-16-23)24(29)17-13-22-14-18-25(26(19-22)33-5)34-28(30)20(2)3/h9-12,14-16,18-20,24,27,29H,6-8,13,17H2,1-5H3/b10-9+