methyl 3-[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[3-[5-(2-fluorophenyl)-2-furyl]propanoylamino]-4-methyl-benzoate CAS Name: 3-[[3-[5-(2-fluorophenyl)-2-furanyl]-1-oxopropyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]-4-methylbenzoate Traditional Name: 3-[3-[5-(2-fluorophenyl)-2-furyl]propanoylamino]-4-methyl-benzoic acid methyl ester Formula: C22H20FNO4 MolecularWeight: 381.396903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CC=C(O2)C3=CC=CC=C3F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CC=C(O2)C3=CC=CC=C3F

InChI

InChI=1S/C22H20FNO4/c1-14-7-8-15(22(26)27-2)13-19(14)24-21(25)12-10-16-9-11-20(28-16)17-5-3-4-6-18(17)23/h3-9,11,13H,10,12H2,1-2H3,(H,24,25)