(5-bromanylpyridin-3-yl)-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methanamine

Systemtic Name: (5-bromanylpyridin-3-yl)-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methanamine Openeye Name: (5-bromo-3-pyridyl)-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methanamine CAS Name: (5-bromo-3-pyridinyl)-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methanamine IUPAC Name: (5-bromopyridin-3-yl)-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methanamine Traditional Name: [(5-bromo-3-pyridyl)-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]amine Formula: C15H14BrClN2O2 MolecularWeight: 369.64086

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)C(C3=CC(=CN=C3)Br)N)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)C(C3=CC(=CN=C3)Br)N)Cl)OC1

InChI

InChI=1S/C15H14BrClN2O2/c16-10-4-9(7-19-8-10)15(18)11-5-13-14(6-12(11)17)21-3-1-2-20-13/h4-8,15H,1-3,18H2