4-[5-(3,5-ditert-butylphenyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(3,5-ditert-butylphenyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(3,5-ditert-butylphenyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-(3,5-ditert-butylphenyl)-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(3,5-ditert-butylphenyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-(3,5-ditert-butylphenyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C22H26N2O2 MolecularWeight: 350.45404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=NNC(=C3C=CC(=O)C=C3)O2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=NNC(=C3C=CC(=O)C=C3)O2)C(C)(C)C

InChI

InChI=1S/C22H26N2O2/c1-21(2,3)16-11-15(12-17(13-16)22(4,5)6)20-24-23-19(26-20)14-7-9-18(25)10-8-14/h7-13,23H,1-6H3