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1-adamantyl-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]azanium

1-adamantyl-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]azanium

Systemtic Name:1-adamantyl-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]azanium
Openeye Name:1-adamantyl-[(4-hydroxy-3,5-dimethyl-phenyl)methyl]ammonium
CAS Name:1-adamantyl-[(4-hydroxy-3,5-dimethylphenyl)methyl]ammonium
IUPAC Name:1-adamantyl-[(4-hydroxy-3,5-dimethylphenyl)methyl]azanium
Traditional Name:1-adamantyl-(4-hydroxy-3,5-dimethyl-benzyl)ammonium
Formula: C19H28NO+
MolecularWeight: 286.43172
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C[NH2+]C23CC4CC(C2)CC(C4)C3


Isomeric SMILES

CC1=CC(=CC(=C1O)C)C[NH2+]C23CC4CC(C2)CC(C4)C3


InChI

InChI=1S/C19H27NO/c1-12-3-17(4-13(2)18(12)21)11-20-19-8-14-5-15(9-19)7-16(6-14)10-19/h3-4,14-16,20-21H,5-11H2,1-2H3/p+1


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