N-[(2,4,5-trimethoxyphenyl)methyl]adamantan-2-amine

Systemtic Name: N-[(2,4,5-trimethoxyphenyl)methyl]adamantan-2-amine Openeye Name: N-[(2,4,5-trimethoxyphenyl)methyl]adamantan-2-amine CAS Name: N-[(2,4,5-trimethoxyphenyl)methyl]-2-adamantanamine IUPAC Name: N-[(2,4,5-trimethoxyphenyl)methyl]adamantan-2-amine Traditional Name: 2-adamantyl-(2,4,5-trimethoxybenzyl)amine Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC2C3CC4CC(C3)CC2C4)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC2C3CC4CC(C3)CC2C4)OC)OC

InChI

InChI=1S/C20H29NO3/c1-22-17-10-19(24-3)18(23-2)9-16(17)11-21-20-14-5-12-4-13(7-14)8-15(20)6-12/h9-10,12-15,20-21H,4-8,11H2,1-3H3