[4,6-bis(4-chlorophenyl)-5-nitro-2-oxidanyl-2-phenyl-cyclohexyl]-phenyl-methanone

Systemtic Name: [4,6-bis(4-chlorophenyl)-5-nitro-2-oxidanyl-2-phenyl-cyclohexyl]-phenyl-methanone Openeye Name: [4,6-bis(4-chlorophenyl)-2-hydroxy-5-nitro-2-phenyl-cyclohexyl]-phenyl-methanone CAS Name: [4,6-bis(4-chlorophenyl)-2-hydroxy-5-nitro-2-phenylcyclohexyl]-phenylmethanone IUPAC Name: [4,6-bis(4-chlorophenyl)-2-hydroxy-5-nitro-2-phenylcyclohexyl]-phenylmethanone Traditional Name: [4,6-bis(4-chlorophenyl)-2-hydroxy-5-nitro-2-phenyl-cyclohexyl]-phenyl-methanone Formula: C31H25Cl2NO4 MolecularWeight: 546.4405

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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)[N+](=O)[O-])C5=CC=C(C=C5)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)[N+](=O)[O-])C5=CC=C(C=C5)Cl

InChI

InChI=1S/C31H25Cl2NO4/c32-24-15-11-20(12-16-24)26-19-31(36,23-9-5-2-6-10-23)28(30(35)22-7-3-1-4-8-22)27(29(26)34(37)38)21-13-17-25(33)18-14-21/h1-18,26-29,36H,19H2