5-bromanyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-ethyl]-2-oxidanyl-benzamide

Systemtic Name: 5-bromanyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-ethyl]-2-oxidanyl-benzamide Openeye Name: 5-bromo-N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-2-hydroxy-benzamide CAS Name: 5-bromo-N-[2-(3,4-dimethoxyphenyl)-2-(4-morpholinyl)ethyl]-2-hydroxybenzamide IUPAC Name: 5-bromo-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-2-hydroxybenzamide Traditional Name: 5-bromo-N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-2-hydroxy-benzamide Formula: C21H25BrN2O5 MolecularWeight: 465.3376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CNC(=O)C2=C(C=CC(=C2)Br)O)N3CCOCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CNC(=O)C2=C(C=CC(=C2)Br)O)N3CCOCC3)OC

InChI

InChI=1S/C21H25BrN2O5/c1-27-19-6-3-14(11-20(19)28-2)17(24-7-9-29-10-8-24)13-23-21(26)16-12-15(22)4-5-18(16)25/h3-6,11-12,17,25H,7-10,13H2,1-2H3,(H,23,26)