3-[(S)-(3,5-ditert-butyl-4-oxidanyl-phenyl)-thiophen-2-yl-methyl]-2-oxidanyl-chromen-4-one

Systemtic Name: 3-[(S)-(3,5-ditert-butyl-4-oxidanyl-phenyl)-thiophen-2-yl-methyl]-2-oxidanyl-chromen-4-one Openeye Name: 3-[(S)-(3,5-ditert-butyl-4-hydroxy-phenyl)-(2-thienyl)methyl]-2-hydroxy-chromen-4-one CAS Name: 3-[(S)-(3,5-ditert-butyl-4-hydroxyphenyl)-thiophen-2-ylmethyl]-2-hydroxy-1-benzopyran-4-one IUPAC Name: 3-[(S)-(3,5-ditert-butyl-4-hydroxyphenyl)-thiophen-2-ylmethyl]-2-hydroxychromen-4-one Traditional Name: 3-[(S)-(3,5-ditert-butyl-4-hydroxy-phenyl)-(2-thienyl)methyl]-2-hydroxy-chromone Formula: C28H30O4S MolecularWeight: 462.6004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C2=CC=CS2)C3=C(OC4=CC=CC=C4C3=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)[C@H](C2=CC=CS2)C3=C(OC4=CC=CC=C4C3=O)O

InChI

InChI=1S/C28H30O4S/c1-27(2,3)18-14-16(15-19(25(18)30)28(4,5)6)22(21-12-9-13-33-21)23-24(29)17-10-7-8-11-20(17)32-26(23)31/h7-15,22,30-31H,1-6H3/t22-/m1/s1