6-(4,6-ditert-butyl-7-oxidanyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: 6-(4,6-ditert-butyl-7-oxidanyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: 6-(4,6-ditert-butyl-7-hydroxy-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one CAS Name: 6-(4,6-ditert-butyl-7-hydroxy-3H-1,3-benzoxazol-2-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: 6-(4,6-ditert-butyl-7-hydroxy-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: 6-(4,6-ditert-butyl-7-hydroxy-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one Formula: C21H25NO3 MolecularWeight: 339.4281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C2=C1NC(=C3C=CC=CC3=O)O2)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C2=C1NC(=C3C=CC=CC3=O)O2)O)C(C)(C)C

InChI

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