N-(4-bromophenyl)-2-[[1-oxidanylidene-2-(pyridin-3-ylmethyl)-3,4-dihydroisoquinolin-5-yl]oxy]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[[1-oxidanylidene-2-(pyridin-3-ylmethyl)-3,4-dihydroisoquinolin-5-yl]oxy]ethanamide Openeye Name: N-(4-bromophenyl)-2-[[1-oxo-2-(3-pyridylmethyl)-3,4-dihydroisoquinolin-5-yl]oxy]acetamide CAS Name: N-(4-bromophenyl)-2-[[1-oxo-2-(3-pyridinylmethyl)-3,4-dihydroisoquinolin-5-yl]oxy]acetamide IUPAC Name: N-(4-bromophenyl)-2-[[1-oxo-2-(pyridin-3-ylmethyl)-3,4-dihydroisoquinolin-5-yl]oxy]acetamide Traditional Name: N-(4-bromophenyl)-2-[[1-keto-2-(3-pyridylmethyl)-3,4-dihydroisoquinolin-5-yl]oxy]acetamide Formula: C23H20BrN3O3 MolecularWeight: 466.3272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C(=CC=C2)OCC(=O)NC3=CC=C(C=C3)Br)CC4=CN=CC=C4

Isomeric SMILES

C1CN(C(=O)C2=C1C(=CC=C2)OCC(=O)NC3=CC=C(C=C3)Br)CC4=CN=CC=C4

InChI

InChI=1S/C23H20BrN3O3/c24-17-6-8-18(9-7-17)26-22(28)15-30-21-5-1-4-20-19(21)10-12-27(23(20)29)14-16-3-2-11-25-13-16/h1-9,11,13H,10,12,14-15H2,(H,26,28)