ethyl 4-fluoranyl-3-[[(E)-3-quinolin-8-ylprop-2-enoyl]oxymethyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[[(E)-3-quinolin-8-ylprop-2-enoyl]oxymethyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[[(E)-3-(8-quinolyl)prop-2-enoyl]oxymethyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[(E)-1-oxo-3-(8-quinolinyl)prop-2-enoxy]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[[(E)-3-quinolin-8-ylprop-2-enoyl]oxymethyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[[(E)-3-(8-quinolyl)acryloyl]oxymethyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C24H18FNO4S MolecularWeight: 435.467423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C=CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)/C=C/C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C24H18FNO4S/c1-2-29-24(28)23-17(21-18(25)9-4-10-19(21)31-23)14-30-20(27)12-11-16-7-3-6-15-8-5-13-26-22(15)16/h3-13H,2,14H2,1H3/b12-11+