3-bromanyl-N-(8-chloranyl-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-(8-chloranyl-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-4-ethoxy-benzamide Openeye Name: 3-bromo-N-(8-chloro-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-4-ethoxy-benzamide CAS Name: 3-bromo-N-(8-chloro-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-4-ethoxybenzamide IUPAC Name: 3-bromo-N-(8-chloro-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-4-ethoxybenzamide Traditional Name: 3-bromo-N-(8-chloro-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-4-ethoxy-benzamide Formula: C21H24BrClN2O2 MolecularWeight: 451.78446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(C=C2)C(CN(C3)C)(C)C)Cl)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(C=C2)C(CN(C3)C)(C)C)Cl)Br

InChI

InChI=1S/C21H24BrClN2O2/c1-5-27-18-9-6-13(10-16(18)22)20(26)24-17-8-7-15-14(19(17)23)11-25(4)12-21(15,2)3/h6-10H,5,11-12H2,1-4H3,(H,24,26)