(E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-1-(4-morpholinophenyl)prop-2-en-1-one CAS Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-1-[4-(4-morpholinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-1-(4-morpholinophenyl)prop-2-en-1-one Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C(=O)C=CC3=CC4=C(C(=C3)Br)OCO4

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)C(=O)/C=C/C3=CC4=C(C(=C3)Br)OCO4

InChI

InChI=1S/C20H18BrNO4/c21-17-11-14(12-19-20(17)26-13-25-19)1-6-18(23)15-2-4-16(5-3-15)22-7-9-24-10-8-22/h1-6,11-12H,7-10,13H2/b6-1+