N-(5-bromanyl-1,2,3,4-tetrahydroisoquinolin-7-yl)-3-ethanoyl-4-ethoxy-benzamide

Systemtic Name: N-(5-bromanyl-1,2,3,4-tetrahydroisoquinolin-7-yl)-3-ethanoyl-4-ethoxy-benzamide Openeye Name: 3-acetyl-N-(5-bromo-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-ethoxy-benzamide CAS Name: 3-acetyl-N-(5-bromo-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-ethoxybenzamide IUPAC Name: 3-acetyl-N-(5-bromo-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-ethoxybenzamide Traditional Name: 3-acetyl-N-(5-bromo-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-ethoxy-benzamide Formula: C20H21BrN2O3 MolecularWeight: 417.29634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCNCC3=C2)Br)C(=O)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCNCC3=C2)Br)C(=O)C

InChI

InChI=1S/C20H21BrN2O3/c1-3-26-19-5-4-13(9-17(19)12(2)24)20(25)23-15-8-14-11-22-7-6-16(14)18(21)10-15/h4-5,8-10,22H,3,6-7,11H2,1-2H3,(H,23,25)