5-[5-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propyl]thiophen-2-yl]-3,3-dimethyl-pentanoic acid

Systemtic Name: 5-[5-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propyl]thiophen-2-yl]-3,3-dimethyl-pentanoic acid Openeye Name: 5-[5-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propyl]-2-thienyl]-3,3-dimethyl-pentanoic acid CAS Name: 5-[5-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propyl]-2-thiophenyl]-3,3-dimethylpentanoic acid IUPAC Name: 5-[5-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propyl]thiophen-2-yl]-3,3-dimethylpentanoic acid Traditional Name: 5-[5-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propyl]-2-thienyl]-3,3-dimethyl-valeric acid Formula: C28H42O3S MolecularWeight: 458.69628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCC2=CC=C(S2)CCC(C)(C)CC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCC2=CC=C(S2)CCC(C)(C)CC(=O)O

InChI

InChI=1S/C28H42O3S/c1-26(2,3)22-16-19(17-23(25(22)31)27(4,5)6)10-9-11-20-12-13-21(32-20)14-15-28(7,8)18-24(29)30/h12-13,16-17,31H,9-11,14-15,18H2,1-8H3,(H,29,30)