N-(1-adamantylmethyl)-2-bromanyl-5-[[4-(2-hydroxyethylamino)piperidin-1-yl]methyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-bromanyl-5-[[4-(2-hydroxyethylamino)piperidin-1-yl]methyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-bromo-5-[[4-(2-hydroxyethylamino)-1-piperidyl]methyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-bromo-5-[[4-(2-hydroxyethylamino)-1-piperidinyl]methyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-bromo-5-[[4-(2-hydroxyethylamino)piperidin-1-yl]methyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-bromo-5-[[4-(2-hydroxyethylamino)piperidino]methyl]benzamide Formula: C26H38BrN3O2 MolecularWeight: 504.50282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCO)CC2=CC(=C(C=C2)Br)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCC1NCCO)CC2=CC(=C(C=C2)Br)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H38BrN3O2/c27-24-2-1-18(16-30-6-3-22(4-7-30)28-5-8-31)12-23(24)25(32)29-17-26-13-19-9-20(14-26)11-21(10-19)15-26/h1-2,12,19-22,28,31H,3-11,13-17H2,(H,29,32)