2-(1-chloranyl-8-fluoranyl-11-iodanyl-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-yl)phenol

Systemtic Name: 2-(1-chloranyl-8-fluoranyl-11-iodanyl-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-yl)phenol Openeye Name: 2-(1-chloro-8-fluoro-11-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-yl)phenol CAS Name: 2-(1-chloro-8-fluoro-11-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-yl)phenol IUPAC Name: 2-(1-chloro-8-fluoro-11-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-yl)phenol Traditional Name: 2-(1-chloro-8-fluoro-11-iodo-5-methyl-10H-pyrimido[4,5-b][1,4]benzodiazocin-6-yl)phenol Formula: C19H13ClFIN4O MolecularWeight: 494.688593

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(=NC3=C1N=CN=C3Cl)I)C=C(C=C2C4=CC=CC=C4O)F

Isomeric SMILES

CN1C2=C(CC(=NC3=C1N=CN=C3Cl)I)C=C(C=C2C4=CC=CC=C4O)F

InChI

InChI=1S/C19H13ClFIN4O/c1-26-17-10(7-15(22)25-16-18(20)23-9-24-19(16)26)6-11(21)8-13(17)12-4-2-3-5-14(12)27/h2-6,8-9,27H,7H2,1H3