1-chloranyl-11-ethoxy-6-fluoranyl-8-iodanyl-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine

Systemtic Name: 1-chloranyl-11-ethoxy-6-fluoranyl-8-iodanyl-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine Openeye Name: 1-chloro-11-ethoxy-6-fluoro-8-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine CAS Name: 1-chloro-11-ethoxy-6-fluoro-8-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine IUPAC Name: 1-chloro-11-ethoxy-6-fluoro-8-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine Traditional Name: 1-chloro-11-ethoxy-6-fluoro-8-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine Formula: C15H13ClFIN4O MolecularWeight: 446.645793

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(N=CN=C2Cl)N(C3=C(C=C(C=C3C1)I)F)C

Isomeric SMILES

CCOC1=NC2=C(N=CN=C2Cl)N(C3=C(C=C(C=C3C1)I)F)C

InChI

InChI=1S/C15H13ClFIN4O/c1-3-23-11-5-8-4-9(18)6-10(17)13(8)22(2)15-12(21-11)14(16)19-7-20-15/h4,6-7H,3,5H2,1-2H3