2-[(5-chloranyl-2-morpholin-4-yl-phenyl)amino]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-[(5-chloranyl-2-morpholin-4-yl-phenyl)amino]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(5-chloro-2-morpholino-anilino)acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[5-chloro-2-(4-morpholinyl)anilino]acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(5-chloro-2-morpholin-4-ylanilino)acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(5-chloro-2-morpholino-anilino)acetamide Formula: C21H22ClN3O5 MolecularWeight: 431.86948

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CNC3=C(C=CC(=C3)Cl)N4CCOCC4)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CNC3=C(C=CC(=C3)Cl)N4CCOCC4)OCO2

InChI

InChI=1S/C21H22ClN3O5/c1-13(26)15-9-19-20(30-12-29-19)10-16(15)24-21(27)11-23-17-8-14(22)2-3-18(17)25-4-6-28-7-5-25/h2-3,8-10,23H,4-7,11-12H2,1H3,(H,24,27)