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

Systemtic Name: 2-butyl-7,9-bis(iodanyl)-4-methyl-1,4-benzoxazepine-3,5-dione Openeye Name: 2-butyl-7,9-diiodo-4-methyl-1,4-benzoxazepine-3,5-dione CAS Name: 2-butyl-7,9-diiodo-4-methyl-1,4-benzoxazepine-3,5-dione IUPAC Name: 2-butyl-7,9-diiodo-4-methyl-1,4-benzoxazepine-3,5-dione Traditional Name: 2-butyl-7,9-diiodo-4-methyl-1,4-benzoxazepine-3,5-quinone Formula: C14H15I2NO3 MolecularWeight: 499.08274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N(C(=O)C2=CC(=CC(=C2O1)I)I)C

Isomeric SMILES

CCCCC1C(=O)N(C(=O)C2=CC(=CC(=C2O1)I)I)C

InChI

InChI=1S/C14H15I2NO3/c1-3-4-5-11-14(19)17(2)13(18)9-6-8(15)7-10(16)12(9)20-11/h6-7,11H,3-5H2,1-2H3