7,9-bis(iodanyl)-4-methyl-2-propyl-1,4-benzoxazepine-3,5-dione

Systemtic Name: 7,9-bis(iodanyl)-4-methyl-2-propyl-1,4-benzoxazepine-3,5-dione Openeye Name: 7,9-diiodo-4-methyl-2-propyl-1,4-benzoxazepine-3,5-dione CAS Name: 7,9-diiodo-4-methyl-2-propyl-1,4-benzoxazepine-3,5-dione IUPAC Name: 7,9-diiodo-4-methyl-2-propyl-1,4-benzoxazepine-3,5-dione Traditional Name: 7,9-diiodo-4-methyl-2-propyl-1,4-benzoxazepine-3,5-quinone Formula: C13H13I2NO3 MolecularWeight: 485.05616

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C(=O)C2=CC(=CC(=C2O1)I)I)C

Isomeric SMILES

CCCC1C(=O)N(C(=O)C2=CC(=CC(=C2O1)I)I)C

InChI

InChI=1S/C13H13I2NO3/c1-3-4-10-13(18)16(2)12(17)8-5-7(14)6-9(15)11(8)19-10/h5-6,10H,3-4H2,1-2H3