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

Systemtic Name: 1-(5-bromanylpyridin-3-yl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methyl-methanamine Openeye Name: 1-(5-bromo-3-pyridyl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methyl-methanamine CAS Name: 1-(5-bromo-3-pyridinyl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methylmethanamine IUPAC Name: 1-(5-bromopyridin-3-yl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methylmethanamine Traditional Name: [(5-bromo-3-pyridyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-methyl-amine Formula: C16H17BrN2O2 MolecularWeight: 349.22238

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Descriptors Computed from Structure

Canonical SMILES:

CNC(C1=CC2=C(C=C1)OCCCO2)C3=CC(=CN=C3)Br

Isomeric SMILES

CNC(C1=CC2=C(C=C1)OCCCO2)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H17BrN2O2/c1-18-16(12-7-13(17)10-19-9-12)11-3-4-14-15(8-11)21-6-2-5-20-14/h3-4,7-10,16,18H,2,5-6H2,1H3