(E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-1-(3-morpholin-4-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-1-(3-morpholin-4-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-1-(3-morpholinophenyl)prop-2-en-1-one CAS Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-1-[3-(4-morpholinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-1-(3-morpholin-4-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-1-(3-morpholinophenyl)prop-2-en-1-one Formula: C21H22BrNO4 MolecularWeight: 432.30768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=CC(=O)C2=CC(=CC=C2)N3CCOCC3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C/C(=O)C2=CC(=CC=C2)N3CCOCC3)Br)OC

InChI

InChI=1S/C21H22BrNO4/c1-25-20-13-15(18(22)14-21(20)26-2)6-7-19(24)16-4-3-5-17(12-16)23-8-10-27-11-9-23/h3-7,12-14H,8-11H2,1-2H3/b7-6+