[(R)-(4-bromophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]azanium

Systemtic Name: [(R)-(4-bromophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]azanium Openeye Name: [(R)-(4-bromophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]ammonium CAS Name: [(R)-(4-bromophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]ammonium IUPAC Name: [(R)-(4-bromophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]azanium Traditional Name: [(R)-(4-bromophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]ammonium Formula: C16H17BrNO2+ MolecularWeight: 335.21568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(C3=CC=C(C=C3)Br)[NH3+])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)[C@@H](C3=CC=C(C=C3)Br)[NH3+])OC1

InChI

InChI=1S/C16H16BrNO2/c17-13-5-2-11(3-6-13)16(18)12-4-7-14-15(10-12)20-9-1-8-19-14/h2-7,10,16H,1,8-9,18H2/p+1/t16-/m1/s1