N-[(6-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(furan-2-yl)ethanamine

Systemtic Name: N-[(6-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(furan-2-yl)ethanamine Openeye Name: N-[(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(2-furyl)ethanamine CAS Name: N-[(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(2-furanyl)ethanamine IUPAC Name: N-[(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(furan-2-yl)ethanamine Traditional Name: (6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-[2-(2-furyl)ethyl]amine Formula: C16H18BrNO3 MolecularWeight: 352.22302

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNCCC3=CC=CO3)Br)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNCCC3=CC=CO3)Br)OC1

InChI

InChI=1S/C16H18BrNO3/c17-14-9-12(10-15-16(14)21-8-2-7-20-15)11-18-5-4-13-3-1-6-19-13/h1,3,6,9-10,18H,2,4-5,7-8,11H2