4-[4,5-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)-3H-1,3-oxazol-2-ylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4,5-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)-3H-1,3-oxazol-2-ylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[4,5-bis(3,5-ditert-butyl-4-hydroxy-phenyl)-3H-oxazol-2-ylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[4,5-bis(3,5-ditert-butyl-4-hydroxyphenyl)-3H-oxazol-2-ylidene]-2,6-dimethoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4,5-bis(3,5-ditert-butyl-4-hydroxyphenyl)-3H-1,3-oxazol-2-ylidene]-2,6-dimethoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[4,5-bis(3,5-ditert-butyl-4-hydroxy-phenyl)-4-oxazolin-2-ylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one Formula: C39H51NO6 MolecularWeight: 629.82534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=C(OC(=C3C=C(C(=O)C(=C3)OC)OC)N2)C4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=C(OC(=C3C=C(C(=O)C(=C3)OC)OC)N2)C4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C39H51NO6/c1-36(2,3)24-15-21(16-25(31(24)41)37(4,5)6)30-34(22-17-26(38(7,8)9)32(42)27(18-22)39(10,11)12)46-35(40-30)23-19-28(44-13)33(43)29(20-23)45-14/h15-20,40-42H,1-14H3