N-[(2,3,4-trimethoxyphenyl)methyl]adamantan-1-amine

Systemtic Name: N-[(2,3,4-trimethoxyphenyl)methyl]adamantan-1-amine Openeye Name: N-[(2,3,4-trimethoxyphenyl)methyl]adamantan-1-amine CAS Name: N-[(2,3,4-trimethoxyphenyl)methyl]-1-adamantanamine IUPAC Name: N-[(2,3,4-trimethoxyphenyl)methyl]adamantan-1-amine Traditional Name: 1-adamantyl-(2,3,4-trimethoxybenzyl)amine Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CNC23CC4CC(C2)CC(C4)C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CNC23CC4CC(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