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

Systemtic Name: 1-chloranyl-8-ethoxy-11-fluoranyl-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-ol Openeye Name: 1-chloro-8-ethoxy-11-fluoro-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-ol CAS Name: 1-chloro-8-ethoxy-11-fluoro-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-ol IUPAC Name: 1-chloro-8-ethoxy-11-fluoro-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-ol Traditional Name: 1-chloro-8-ethoxy-11-fluoro-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-ol Formula: C15H14ClFN4O2 MolecularWeight: 336.748663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C2C(=C1)CC(=NC3=C(N2C)N=CN=C3Cl)F)O

Isomeric SMILES

CCOC1=CC(=C2C(=C1)CC(=NC3=C(N2C)N=CN=C3Cl)F)O

InChI

InChI=1S/C15H14ClFN4O2/c1-3-23-9-4-8-5-11(17)20-12-14(16)18-7-19-15(12)21(2)13(8)10(22)6-9/h4,6-7,22H,3,5H2,1-2H3