N-(1-adamantyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide

Systemtic Name: N-(1-adamantyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Openeye Name: N-(1-adamantyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide CAS Name: N-(1-adamantyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide IUPAC Name: N-(1-adamantyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Traditional Name: N-(1-adamantyl)-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Formula: C27H32N2O MolecularWeight: 400.55578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H32N2O/c30-26(28-27-14-20-11-21(15-27)13-22(12-20)16-27)24-7-5-19(6-8-24)17-29-10-9-23-3-1-2-4-25(23)18-29/h1-8,20-22H,9-18H2,(H,28,30)