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2-adamantyl-[[3,5-bis(chloranyl)-4-ethoxy-phenyl]methyl]azanium

2-adamantyl-[[3,5-bis(chloranyl)-4-ethoxy-phenyl]methyl]azanium

Systemtic Name:2-adamantyl-[[3,5-bis(chloranyl)-4-ethoxy-phenyl]methyl]azanium
Openeye Name:2-adamantyl-[(3,5-dichloro-4-ethoxy-phenyl)methyl]ammonium
CAS Name:2-adamantyl-[(3,5-dichloro-4-ethoxyphenyl)methyl]ammonium
IUPAC Name:2-adamantyl-[(3,5-dichloro-4-ethoxyphenyl)methyl]azanium
Traditional Name:2-adamantyl-(3,5-dichloro-4-ethoxy-benzyl)ammonium
Formula: C19H26Cl2NO+
MolecularWeight: 355.32184
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C[NH2+]C2C3CC4CC(C3)CC2C4)Cl


Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C[NH2+]C2C3CC4CC(C3)CC2C4)Cl


InChI

InChI=1S/C19H25Cl2NO/c1-2-23-19-16(20)8-13(9-17(19)21)10-22-18-14-4-11-3-12(6-14)7-15(18)5-11/h8-9,11-12,14-15,18,22H,2-7,10H2,1H3/p+1


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