2,5-bis(bromanyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)aniline

Systemtic Name: 2,5-bis(bromanyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)aniline Openeye Name: 2,5-dibromo-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)aniline CAS Name: 2,5-dibromo-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)aniline IUPAC Name: 2,5-dibromo-N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)aniline Traditional Name: (2,5-dibromophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)amine Formula: C16H15Br2NO2 MolecularWeight: 413.1038

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC(=C2OC1)CNC3=C(C=CC(=C3)Br)Br

Isomeric SMILES

C1COC2=CC=CC(=C2OC1)CNC3=C(C=CC(=C3)Br)Br

InChI

InChI=1S/C16H15Br2NO2/c17-12-5-6-13(18)14(9-12)19-10-11-3-1-4-15-16(11)21-8-2-7-20-15/h1,3-6,9,19H,2,7-8,10H2