N-(1-adamantylcarbamoyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)propanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)propanamide Traditional Name: N-(1-adamantylcarbamoyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)propionamide Formula: C23H31N3O2 MolecularWeight: 381.51114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C23H31N3O2/c1-15(26-7-6-19-4-2-3-5-20(19)14-26)21(27)24-22(28)25-23-11-16-8-17(12-23)10-18(9-16)13-23/h2-5,15-18H,6-14H2,1H3,(H2,24,25,27,28)