2-(3,5-dimethyl-1-adamantyl)-N-[2-(2-dimethylaminoethyl)-1-oxidanylidene-isoquinolin-5-yl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(2-dimethylaminoethyl)-1-oxidanylidene-isoquinolin-5-yl]ethanamide Openeye Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(2-dimethylaminoethyl)-1-oxo-5-isoquinolyl]acetamide CAS Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(2-dimethylaminoethyl)-1-oxo-5-isoquinolinyl]acetamide IUPAC Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(2-dimethylaminoethyl)-1-oxoisoquinolin-5-yl]acetamide Traditional Name: 2-(3,5-dimethyl-1-adamantyl)-N-[2-(2-dimethylaminoethyl)-1-keto-5-isoquinolyl]acetamide Formula: C27H37N3O2 MolecularWeight: 435.60158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)CC(=O)NC4=CC=CC5=C4C=CN(C5=O)CCN(C)C)C

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)CC(=O)NC4=CC=CC5=C4C=CN(C5=O)CCN(C)C)C

InChI

InChI=1S/C27H37N3O2/c1-25-12-19-13-26(2,16-25)18-27(14-19,17-25)15-23(31)28-22-7-5-6-21-20(22)8-9-30(24(21)32)11-10-29(3)4/h5-9,19H,10-18H2,1-4H3,(H,28,31)