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

Systemtic Name: 2-bromanyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-ethyl]benzamide Openeye Name: 2-bromo-N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]benzamide CAS Name: 2-bromo-N-[2-(3,4-dimethoxyphenyl)-2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 2-bromo-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]benzamide Traditional Name: 2-bromo-N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]benzamide Formula: C21H25BrN2O4 MolecularWeight: 449.3382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CNC(=O)C2=CC=CC=C2Br)N3CCOCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CNC(=O)C2=CC=CC=C2Br)N3CCOCC3)OC

InChI

InChI=1S/C21H25BrN2O4/c1-26-19-8-7-15(13-20(19)27-2)18(24-9-11-28-12-10-24)14-23-21(25)16-5-3-4-6-17(16)22/h3-8,13,18H,9-12,14H2,1-2H3,(H,23,25)