N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]ethanamide

Systemtic Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]ethanamide Openeye Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]acetamide CAS Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetamide IUPAC Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetamide Traditional Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[methyl(veratryl)amino]acetamide Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)CC(=O)N(CCC#N)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)CC(=O)N(CCC#N)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H35N3O3/c1-27(16-18-5-6-22(30-2)23(12-18)31-3)17-24(29)28(8-4-7-26)25-13-19-9-20(14-25)11-21(10-19)15-25/h5-6,12,19-21H,4,8-11,13-17H2,1-3H3