4-tert-butyl-7-iodanyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione

Systemtic Name: 4-tert-butyl-7-iodanyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione Openeye Name: 4-tert-butyl-7-iodo-1,3-dihydro-1,4-benzodiazepine-2,5-dione CAS Name: 4-tert-butyl-7-iodo-1,3-dihydro-1,4-benzodiazepine-2,5-dione IUPAC Name: 4-tert-butyl-7-iodo-1,3-dihydro-1,4-benzodiazepine-2,5-dione Traditional Name: 4-tert-butyl-7-iodo-1,3-dihydro-1,4-benzodiazepine-2,5-quinone Formula: C13H15IN2O2 MolecularWeight: 358.17487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(=O)NC2=C(C1=O)C=C(C=C2)I

Isomeric SMILES

CC(C)(C)N1CC(=O)NC2=C(C1=O)C=C(C=C2)I

InChI

InChI=1S/C13H15IN2O2/c1-13(2,3)16-7-11(17)15-10-5-4-8(14)6-9(10)12(16)18/h4-6H,7H2,1-3H3,(H,15,17)