[2,6-bis(4-methoxyphenyl)thian-2-yl] 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: [2,6-bis(4-methoxyphenyl)thian-2-yl] 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate Openeye Name: [2,6-bis(4-methoxyphenyl)tetrahydrothiopyran-2-yl] 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoate CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid [2,6-bis(4-methoxyphenyl)-2-thianyl] ester IUPAC Name: [2,6-bis(4-methoxyphenyl)thian-2-yl] 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propionic acid [2,6-bis(4-methoxyphenyl)tetrahydrothiopyran-2-yl] ester Formula: C36H46O5S MolecularWeight: 590.81244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OC2(CCCC(S2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OC2(CCCC(S2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C36H46O5S/c1-34(2,3)29-22-24(23-30(33(29)38)35(4,5)6)11-20-32(37)41-36(26-14-18-28(40-8)19-15-26)21-9-10-31(42-36)25-12-16-27(39-7)17-13-25/h12-19,22-23,31,38H,9-11,20-21H2,1-8H3