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

Systemtic Name: 3-iodanyl-3-methyl-6-phenyl-cyclohexa-1,4-diene Openeye Name: 3-iodo-3-methyl-6-phenyl-cyclohexa-1,4-diene CAS Name: 3-iodo-3-methyl-6-phenylcyclohexa-1,4-diene IUPAC Name: 3-iodo-3-methyl-6-phenylcyclohexa-1,4-diene Traditional Name: 3-iodo-3-methyl-6-phenyl-cyclohexa-1,4-diene Formula: C13H13I MolecularWeight: 296.14679

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(C=C1)C2=CC=CC=C2)I

Isomeric SMILES

CC1(C=CC(C=C1)C2=CC=CC=C2)I

InChI

InChI=1S/C13H13I/c1-13(14)9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10,12H,1H3