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2-adamantyl-[[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl]azanium

2-adamantyl-[[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl]azanium

Systemtic Name:2-adamantyl-[[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl]azanium
Openeye Name:2-adamantyl-[(4-benzyloxy-3,5-dibromo-phenyl)methyl]ammonium
CAS Name:2-adamantyl-[(3,5-dibromo-4-phenylmethoxyphenyl)methyl]ammonium
IUPAC Name:2-adamantyl-[(3,5-dibromo-4-phenylmethoxyphenyl)methyl]azanium
Traditional Name:2-adamantyl-(4-benzoxy-3,5-dibromo-benzyl)ammonium
Formula: C24H28Br2NO+
MolecularWeight: 506.29322
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3[NH2+]CC4=CC(=C(C(=C4)Br)OCC5=CC=CC=C5)Br


Isomeric SMILES

C1C2CC3CC1CC(C2)C3[NH2+]CC4=CC(=C(C(=C4)Br)OCC5=CC=CC=C5)Br


InChI

InChI=1S/C24H27Br2NO/c25-21-11-18(12-22(26)24(21)28-14-15-4-2-1-3-5-15)13-27-23-19-7-16-6-17(9-19)10-20(23)8-16/h1-5,11-12,16-17,19-20,23,27H,6-10,13-14H2/p+1


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