3-(1,3-benzodioxol-5-yl)-N-(5-bromanyl-2-morpholin-4-yl-phenyl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(5-bromanyl-2-morpholin-4-yl-phenyl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(5-bromo-2-morpholino-phenyl)propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[5-bromo-2-(4-morpholinyl)phenyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(5-bromo-2-morpholin-4-ylphenyl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(5-bromo-2-morpholino-phenyl)propionamide Formula: C20H21BrN2O4 MolecularWeight: 433.29574

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Br)NC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)Br)NC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21BrN2O4/c21-15-3-4-17(23-7-9-25-10-8-23)16(12-15)22-20(24)6-2-14-1-5-18-19(11-14)27-13-26-18/h1,3-5,11-12H,2,6-10,13H2,(H,22,24)