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

Systemtic Name: 6-bromanyl-1,8-bis(chloranyl)-11-ethoxy-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine Openeye Name: 6-bromo-1,8-dichloro-11-ethoxy-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine CAS Name: 6-bromo-1,8-dichloro-11-ethoxy-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine IUPAC Name: 6-bromo-1,8-dichloro-11-ethoxy-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine Traditional Name: 6-bromo-1,8-dichloro-11-ethoxy-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocine Formula: C15H13BrCl2N4O MolecularWeight: 416.09992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(N=CN=C2Cl)N(C3=C(C=C(C=C3C1)Cl)Br)C

Isomeric SMILES

CCOC1=NC2=C(N=CN=C2Cl)N(C3=C(C=C(C=C3C1)Cl)Br)C

InChI

InChI=1S/C15H13BrCl2N4O/c1-3-23-11-5-8-4-9(17)6-10(16)13(8)22(2)15-12(21-11)14(18)19-7-20-15/h4,6-7H,3,5H2,1-2H3