methyl 4-[[(Z)-3-(4-fluorophenyl)-2-thiophen-2-yl-prop-2-enoyl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[(Z)-3-(4-fluorophenyl)-2-thiophen-2-yl-prop-2-enoyl]oxymethyl]benzoate Openeye Name: methyl 4-[[(Z)-3-(4-fluorophenyl)-2-(2-thienyl)prop-2-enoyl]oxymethyl]benzoate CAS Name: 4-[[(Z)-3-(4-fluorophenyl)-1-oxo-2-thiophen-2-ylprop-2-enoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(Z)-3-(4-fluorophenyl)-2-thiophen-2-ylprop-2-enoyl]oxymethyl]benzoate Traditional Name: 4-[[(Z)-3-(4-fluorophenyl)-2-(2-thienyl)acryloyl]oxymethyl]benzoic acid methyl ester Formula: C22H17FO4S MolecularWeight: 396.431383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)C(=CC2=CC=C(C=C2)F)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)/C(=C/C2=CC=C(C=C2)F)/C3=CC=CS3

InChI

InChI=1S/C22H17FO4S/c1-26-21(24)17-8-4-16(5-9-17)14-27-22(25)19(20-3-2-12-28-20)13-15-6-10-18(23)11-7-15/h2-13H,14H2,1H3/b19-13+