(E)-3-(4-butoxyphenyl)-1-(5-fluoranyl-3-methyl-1-benzofuran-2-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-butoxyphenyl)-1-(5-fluoranyl-3-methyl-1-benzofuran-2-yl)prop-2-en-1-one Openeye Name: (E)-3-(4-butoxyphenyl)-1-(5-fluoro-3-methyl-benzofuran-2-yl)prop-2-en-1-one CAS Name: (E)-3-(4-butoxyphenyl)-1-(5-fluoro-3-methyl-2-benzofuranyl)-2-propen-1-one IUPAC Name: (E)-3-(4-butoxyphenyl)-1-(5-fluoro-3-methyl-1-benzofuran-2-yl)prop-2-en-1-one Traditional Name: (E)-3-(4-butoxyphenyl)-1-(5-fluoro-3-methyl-benzofuran-2-yl)prop-2-en-1-one Formula: C22H21FO3 MolecularWeight: 352.398743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=CC(=O)C2=C(C3=C(O2)C=CC(=C3)F)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C/C(=O)C2=C(C3=C(O2)C=CC(=C3)F)C

InChI

InChI=1S/C22H21FO3/c1-3-4-13-25-18-9-5-16(6-10-18)7-11-20(24)22-15(2)19-14-17(23)8-12-21(19)26-22/h5-12,14H,3-4,13H2,1-2H3/b11-7+