8-bromanyl-1,6-bis(chloranyl)-11-iodanyl-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine

Systemtic Name: 8-bromanyl-1,6-bis(chloranyl)-11-iodanyl-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine Openeye Name: 8-bromo-1,6-dichloro-11-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine CAS Name: 8-bromo-1,6-dichloro-11-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine IUPAC Name: 8-bromo-1,6-dichloro-11-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine Traditional Name: 8-bromo-1,6-dichloro-11-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine Formula: C13H8BrCl2IN4 MolecularWeight: 497.94389

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2CC(=NC3=C1N=CN=C3Cl)I)Br)Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2CC(=NC3=C1N=CN=C3Cl)I)Br)Cl

InChI

InChI=1S/C13H8BrCl2IN4/c1-21-11-6(2-7(14)4-8(11)15)3-9(17)20-10-12(16)18-5-19-13(10)21/h2,4-5H,3H2,1H3