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2-adamantyl-[(5-bromanyl-2-ethoxy-3-methoxy-phenyl)methyl]azanium

2-adamantyl-[(5-bromanyl-2-ethoxy-3-methoxy-phenyl)methyl]azanium

Systemtic Name:2-adamantyl-[(5-bromanyl-2-ethoxy-3-methoxy-phenyl)methyl]azanium
Openeye Name:2-adamantyl-[(5-bromo-2-ethoxy-3-methoxy-phenyl)methyl]ammonium
CAS Name:2-adamantyl-[(5-bromo-2-ethoxy-3-methoxyphenyl)methyl]ammonium
IUPAC Name:2-adamantyl-[(5-bromo-2-ethoxy-3-methoxyphenyl)methyl]azanium
Traditional Name:2-adamantyl-(5-bromo-2-ethoxy-3-methoxy-benzyl)ammonium
Formula: C20H29BrNO2+
MolecularWeight: 395.35376
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C[NH2+]C2C3CC4CC(C3)CC2C4)Br)OC


Isomeric SMILES

CCOC1=C(C=C(C=C1C[NH2+]C2C3CC4CC(C3)CC2C4)Br)OC


InChI

InChI=1S/C20H28BrNO2/c1-3-24-20-16(9-17(21)10-18(20)23-2)11-22-19-14-5-12-4-13(7-14)8-15(19)6-12/h9-10,12-15,19,22H,3-8,11H2,1-2H3/p+1


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