(E)-1-(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(3-fluoro-4-pyrrolidin-1-yl-phenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-[3-fluoro-4-(1-pyrrolidinyl)phenyl]-3-(2,4,5-trimethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(3-fluoro-4-pyrrolidin-1-ylphenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-asaryl-1-(3-fluoro-4-pyrrolidino-phenyl)prop-2-en-1-one Formula: C22H24FNO4 MolecularWeight: 385.428663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)C2=CC(=C(C=C2)N3CCCC3)F)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)C2=CC(=C(C=C2)N3CCCC3)F)OC)OC

InChI

InChI=1S/C22H24FNO4/c1-26-20-14-22(28-3)21(27-2)13-16(20)7-9-19(25)15-6-8-18(17(23)12-15)24-10-4-5-11-24/h6-9,12-14H,4-5,10-11H2,1-3H3/b9-7+