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

Systemtic Name: N-[5-bromanyl-2-(2-methylbutyl)-7-nitro-3,4-dihydro-1H-isoquinolin-8-yl]ethanamide Openeye Name: N-[5-bromo-2-(2-methylbutyl)-7-nitro-3,4-dihydro-1H-isoquinolin-8-yl]acetamide CAS Name: N-[5-bromo-2-(2-methylbutyl)-7-nitro-3,4-dihydro-1H-isoquinolin-8-yl]acetamide IUPAC Name: N-[5-bromo-2-(2-methylbutyl)-7-nitro-3,4-dihydro-1H-isoquinolin-8-yl]acetamide Traditional Name: N-[5-bromo-2-(2-methylbutyl)-7-nitro-3,4-dihydro-1H-isoquinolin-8-yl]acetamide Formula: C16H22BrN3O3 MolecularWeight: 384.26818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1CCC2=C(C=C(C(=C2C1)NC(=O)C)[N+](=O)[O-])Br

Isomeric SMILES

CCC(C)CN1CCC2=C(C=C(C(=C2C1)NC(=O)C)[N+](=O)[O-])Br

InChI

InChI=1S/C16H22BrN3O3/c1-4-10(2)8-19-6-5-12-13(9-19)16(18-11(3)21)15(20(22)23)7-14(12)17/h7,10H,4-6,8-9H2,1-3H3,(H,18,21)