5-[(6-bromanylpyridin-3-yl)methyl]-3-chloranyl-6H-benzo[b][1,4]benzoxazepine

Systemtic Name: 5-[(6-bromanylpyridin-3-yl)methyl]-3-chloranyl-6H-benzo[b][1,4]benzoxazepine Openeye Name: 5-[(6-bromo-3-pyridyl)methyl]-3-chloro-6H-benzo[b][1,4]benzoxazepine CAS Name: 5-[(6-bromo-3-pyridinyl)methyl]-3-chloro-6H-benzo[b][1,4]benzoxazepine IUPAC Name: 5-[(6-bromopyridin-3-yl)methyl]-3-chloro-6H-benzo[b][1,4]benzoxazepine Traditional Name: 5-[(6-bromo-3-pyridyl)methyl]-3-chloro-6H-benzo[b][1,4]benzoxazepine Formula: C19H14BrClN2O MolecularWeight: 401.68426

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=C(N1CC4=CN=C(C=C4)Br)C=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2OC3=C(N1CC4=CN=C(C=C4)Br)C=C(C=C3)Cl

InChI

InChI=1S/C19H14BrClN2O/c20-19-8-5-13(10-22-19)11-23-12-14-3-1-2-4-17(14)24-18-7-6-15(21)9-16(18)23/h1-10H,11-12H2