4-[5-(dioxidanyl)-4,5-diphenyl-1H-imidazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(dioxidanyl)-4,5-diphenyl-1H-imidazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-(5-hydroperoxy-4,5-diphenyl-1H-imidazol-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(5-hydroperoxy-4,5-diphenyl-1H-imidazol-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(5-hydroperoxy-4,5-diphenyl-1H-imidazol-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(4-hydroperoxy-4,5-diphenyl-3-imidazolin-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C21H16N2O3 MolecularWeight: 344.36334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C3C=CC(=O)C=C3)NC2(C4=CC=CC=C4)OO

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C3C=CC(=O)C=C3)NC2(C4=CC=CC=C4)OO

InChI

InChI=1S/C21H16N2O3/c24-18-13-11-16(12-14-18)20-22-19(15-7-3-1-4-8-15)21(23-20,26-25)17-9-5-2-6-10-17/h1-14,23,25H