N-(5-bromanyl-2-butan-2-yl-7-nitro-3,4-dihydro-1H-isoquinolin-8-yl)ethanamide

Systemtic Name: N-(5-bromanyl-2-butan-2-yl-7-nitro-3,4-dihydro-1H-isoquinolin-8-yl)ethanamide Openeye Name: N-(5-bromo-7-nitro-2-sec-butyl-3,4-dihydro-1H-isoquinolin-8-yl)acetamide CAS Name: N-(5-bromo-2-butan-2-yl-7-nitro-3,4-dihydro-1H-isoquinolin-8-yl)acetamide IUPAC Name: N-(5-bromo-2-butan-2-yl-7-nitro-3,4-dihydro-1H-isoquinolin-8-yl)acetamide Traditional Name: N-(5-bromo-7-nitro-2-sec-butyl-3,4-dihydro-1H-isoquinolin-8-yl)acetamide Formula: C15H20BrN3O3 MolecularWeight: 370.2416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCC2=C(C=C(C(=C2C1)NC(=O)C)[N+](=O)[O-])Br

Isomeric SMILES

CCC(C)N1CCC2=C(C=C(C(=C2C1)NC(=O)C)[N+](=O)[O-])Br

InChI

InChI=1S/C15H20BrN3O3/c1-4-9(2)18-6-5-11-12(8-18)15(17-10(3)20)14(19(21)22)7-13(11)16/h7,9H,4-6,8H2,1-3H3,(H,17,20)