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

Systemtic Name: (7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-pyridin-4-yl-methanamine Openeye Name: (7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(4-pyridyl)methanamine CAS Name: (7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-pyridin-4-ylmethanamine IUPAC Name: (7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-pyridin-4-ylmethanamine Traditional Name: [(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(4-pyridyl)methyl]amine Formula: C15H15BrN2O2 MolecularWeight: 335.1958

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)C(C3=CC=NC=C3)N)Br)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)C(C3=CC=NC=C3)N)Br)OC1

InChI

InChI=1S/C15H15BrN2O2/c16-12-9-14-13(19-6-1-7-20-14)8-11(12)15(17)10-2-4-18-5-3-10/h2-5,8-9,15H,1,6-7,17H2