3-[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1,3-thiazol-2-yl]propanoic acid

Systemtic Name: 3-[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1,3-thiazol-2-yl]propanoic acid Openeye Name: 3-[4-(3,5-ditert-butyl-4-hydroxy-phenyl)thiazol-2-yl]propanoic acid CAS Name: 3-[4-(3,5-ditert-butyl-4-hydroxyphenyl)-2-thiazolyl]propanoic acid IUPAC Name: 3-[4-(3,5-ditert-butyl-4-hydroxyphenyl)-1,3-thiazol-2-yl]propanoic acid Traditional Name: 3-[4-(3,5-ditert-butyl-4-hydroxy-phenyl)thiazol-2-yl]propionic acid Formula: C20H27NO3S MolecularWeight: 361.49828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CSC(=N2)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CSC(=N2)CCC(=O)O

InChI

InChI=1S/C20H27NO3S/c1-19(2,3)13-9-12(10-14(18(13)24)20(4,5)6)15-11-25-16(21-15)7-8-17(22)23/h9-11,24H,7-8H2,1-6H3,(H,22,23)