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1-adamantyl-[(2,4,5-trimethoxyphenyl)methyl]azanium

1-adamantyl-[(2,4,5-trimethoxyphenyl)methyl]azanium

Systemtic Name:1-adamantyl-[(2,4,5-trimethoxyphenyl)methyl]azanium
Openeye Name:1-adamantyl-[(2,4,5-trimethoxyphenyl)methyl]ammonium
CAS Name:1-adamantyl-[(2,4,5-trimethoxyphenyl)methyl]ammonium
IUPAC Name:1-adamantyl-[(2,4,5-trimethoxyphenyl)methyl]azanium
Traditional Name:1-adamantyl-(2,4,5-trimethoxybenzyl)ammonium
Formula: C20H30NO3+
MolecularWeight: 332.4571
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH2+]C23CC4CC(C2)CC(C4)C3)OC)OC


Isomeric SMILES

COC1=CC(=C(C=C1C[NH2+]C23CC4CC(C2)CC(C4)C3)OC)OC


InChI

InChI=1S/C20H29NO3/c1-22-17-8-19(24-3)18(23-2)7-16(17)12-21-20-9-13-4-14(10-20)6-15(5-13)11-20/h7-8,13-15,21H,4-6,9-12H2,1-3H3/p+1


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