1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-3-(3-bromanyl-4-fluoranyl-phenyl)prop-2-en-1-one

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-3-(3-bromanyl-4-fluoranyl-phenyl)prop-2-en-1-one Openeye Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-3-(3-bromo-4-fluoro-phenyl)prop-2-en-1-one CAS Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)-4-morpholinyl]-3-(3-bromo-4-fluorophenyl)-2-propen-1-one IUPAC Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-3-(3-bromo-4-fluorophenyl)prop-2-en-1-one Traditional Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholino]-3-(3-bromo-4-fluoro-phenyl)prop-2-en-1-one Formula: C21H19BrFNO5 MolecularWeight: 464.281663

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=O)C=CC2=CC(=C(C=C2)F)Br)COC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COC(CN1C(=O)C=CC2=CC(=C(C=C2)F)Br)COC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H19BrFNO5/c22-17-9-14(1-4-18(17)23)2-6-21(25)24-7-8-26-16(11-24)12-27-15-3-5-19-20(10-15)29-13-28-19/h1-6,9-10,16H,7-8,11-13H2