4-bromanyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3,5-dimethoxy-benzamide

Systemtic Name: 4-bromanyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3,5-dimethoxy-benzamide Openeye Name: 4-bromo-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3,5-dimethoxy-benzamide CAS Name: 4-bromo-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-3,5-dimethoxybenzamide IUPAC Name: 4-bromo-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-3,5-dimethoxybenzamide Traditional Name: 4-bromo-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3,5-dimethoxy-benzamide Formula: C22H27BrN2O3 MolecularWeight: 447.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC(=C(C(=C1)OC)Br)OC)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(CNC(=O)C1=CC(=C(C(=C1)OC)Br)OC)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C22H27BrN2O3/c1-22(2,25-10-9-15-7-5-6-8-16(15)13-25)14-24-21(26)17-11-18(27-3)20(23)19(12-17)28-4/h5-8,11-12H,9-10,13-14H2,1-4H3,(H,24,26)