2,6-ditert-butyl-4-(5-oxidanyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4-(5-oxidanyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-(5-hydroxy-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-(5-hydroxy-3H-1,3-benzoxazol-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-(5-hydroxy-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-(5-hydroxy-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2NC3=C(O2)C=CC(=C3)O)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2NC3=C(O2)C=CC(=C3)O)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C21H25NO3/c1-20(2,3)14-9-12(10-15(18(14)24)21(4,5)6)19-22-16-11-13(23)7-8-17(16)25-19/h7-11,22-23H,1-6H3