(3-cyanophenyl)methyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: (3-cyanophenyl)methyl 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylic acid (3-cyanobenzyl) ester Formula: C19H14FNO3S MolecularWeight: 355.382763

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)OCC3=CC=CC(=C3)C#N

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)OCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H14FNO3S/c1-23-11-14-17-15(20)6-3-7-16(17)25-18(14)19(22)24-10-13-5-2-4-12(8-13)9-21/h2-8H,10-11H2,1H3