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1-adamantyl-[(2,3,4-trimethoxyphenyl)methyl]azanium

1-adamantyl-[(2,3,4-trimethoxyphenyl)methyl]azanium

Systemtic Name:1-adamantyl-[(2,3,4-trimethoxyphenyl)methyl]azanium
Openeye Name:1-adamantyl-[(2,3,4-trimethoxyphenyl)methyl]ammonium
CAS Name:1-adamantyl-[(2,3,4-trimethoxyphenyl)methyl]ammonium
IUPAC Name:1-adamantyl-[(2,3,4-trimethoxyphenyl)methyl]azanium
Traditional Name:1-adamantyl-(2,3,4-trimethoxybenzyl)ammonium
Formula: C20H30NO3+
MolecularWeight: 332.4571
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C[NH2+]C23CC4CC(C2)CC(C4)C3)OC)OC


Isomeric SMILES

COC1=C(C(=C(C=C1)C[NH2+]C23CC4CC(C2)CC(C4)C3)OC)OC


InChI

InChI=1S/C20H29NO3/c1-22-17-5-4-16(18(23-2)19(17)24-3)12-21-20-9-13-6-14(10-20)8-15(7-13)11-20/h4-5,13-15,21H,6-12H2,1-3H3/p+1


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