N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanamide

Systemtic Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanamide Openeye Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]acetamide CAS Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]acetamide IUPAC Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]acetamide Traditional Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(2-methoxy-5-methyl-benzyl)-methyl-amino]acetamide Formula: C25H35N3O2 MolecularWeight: 409.5643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35N3O2/c1-18-5-6-23(30-3)22(9-18)16-27(2)17-24(29)28(8-4-7-26)25-13-19-10-20(14-25)12-21(11-19)15-25/h5-6,9,19-21H,4,8,10-17H2,1-3H3