[2,6-bis(4-chlorophenyl)thian-4-yl] 3,5-ditert-butyl-4-oxidanyl-benzoate

Systemtic Name: [2,6-bis(4-chlorophenyl)thian-4-yl] 3,5-ditert-butyl-4-oxidanyl-benzoate Openeye Name: [2,6-bis(4-chlorophenyl)tetrahydrothiopyran-4-yl] 3,5-ditert-butyl-4-hydroxy-benzoate CAS Name: 3,5-ditert-butyl-4-hydroxybenzoic acid [2,6-bis(4-chlorophenyl)-4-thianyl] ester IUPAC Name: [2,6-bis(4-chlorophenyl)thian-4-yl] 3,5-ditert-butyl-4-hydroxybenzoate Traditional Name: 3,5-ditert-butyl-4-hydroxy-benzoic acid [2,6-bis(4-chlorophenyl)tetrahydrothiopyran-4-yl] ester Formula: C32H36Cl2O3S MolecularWeight: 571.59744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OC2CC(SC(C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OC2CC(SC(C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C32H36Cl2O3S/c1-31(2,3)25-15-21(16-26(29(25)35)32(4,5)6)30(36)37-24-17-27(19-7-11-22(33)12-8-19)38-28(18-24)20-9-13-23(34)14-10-20/h7-16,24,27-28,35H,17-18H2,1-6H3