2,6-bis(3,4-dichlorophenyl)-4-oxidanyl-4-phenyl-3-(phenylcarbonyl)cyclohexane-1,1-dicarbonitrile

Systemtic Name: 2,6-bis(3,4-dichlorophenyl)-4-oxidanyl-4-phenyl-3-(phenylcarbonyl)cyclohexane-1,1-dicarbonitrile Openeye Name: 3-benzoyl-2,6-bis(3,4-dichlorophenyl)-4-hydroxy-4-phenyl-cyclohexane-1,1-dicarbonitrile CAS Name: 3-benzoyl-2,6-bis(3,4-dichlorophenyl)-4-hydroxy-4-phenylcyclohexane-1,1-dicarbonitrile IUPAC Name: 3-benzoyl-2,6-bis(3,4-dichlorophenyl)-4-hydroxy-4-phenylcyclohexane-1,1-dicarbonitrile Traditional Name: 3-benzoyl-2,6-bis(3,4-dichlorophenyl)-4-hydroxy-4-phenyl-cyclohexane-1,1-dicarbonitrile Formula: C33H22Cl4N2O2 MolecularWeight: 620.35198

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(C1(C2=CC=CC=C2)O)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)(C#N)C#N)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1C(C(C(C(C1(C2=CC=CC=C2)O)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)(C#N)C#N)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C33H22Cl4N2O2/c34-25-13-11-21(15-27(25)36)24-17-33(41,23-9-5-2-6-10-23)30(31(40)20-7-3-1-4-8-20)29(32(24,18-38)19-39)22-12-14-26(35)28(37)16-22/h1-16,24,29-30,41H,17H2