3-iodanyl-3-nitro-6-phenyl-cyclohexa-1,4-diene

Systemtic Name: 3-iodanyl-3-nitro-6-phenyl-cyclohexa-1,4-diene Openeye Name: 3-iodo-3-nitro-6-phenyl-cyclohexa-1,4-diene CAS Name: 3-iodo-3-nitro-6-phenylcyclohexa-1,4-diene IUPAC Name: 3-iodo-3-nitro-6-phenylcyclohexa-1,4-diene Traditional Name: 3-iodo-3-nitro-6-phenyl-cyclohexa-1,4-diene Formula: C12H10INO2 MolecularWeight: 327.11777

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=CC(C=C2)([N+](=O)[O-])I

Isomeric SMILES

C1=CC=C(C=C1)C2C=CC(C=C2)([N+](=O)[O-])I

InChI

InChI=1S/C12H10INO2/c13-12(14(15)16)8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,11H