3-bromanyl-4-tert-butyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide

Systemtic Name: 3-bromanyl-4-tert-butyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Openeye Name: 3-bromo-4-tert-butyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide CAS Name: 3-bromo-4-tert-butyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide IUPAC Name: 3-bromo-4-tert-butyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Traditional Name: 3-bromo-4-tert-butyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Formula: C21H25BrN2O MolecularWeight: 401.34

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C)C=C2)Br

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C)C=C2)Br

InChI

InChI=1S/C21H25BrN2O/c1-21(2,3)18-8-6-15(12-19(18)22)20(25)23-17-7-5-14-9-10-24(4)13-16(14)11-17/h5-8,11-12H,9-10,13H2,1-4H3,(H,23,25)