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(5-cyano-2-fluoranyl-phenyl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

(5-cyano-2-fluoranyl-phenyl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name:(5-cyano-2-fluoranyl-phenyl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate
Openeye Name:(5-cyano-2-fluoro-phenyl)methyl 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate
CAS Name:4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (5-cyano-2-fluorophenyl)methyl ester
IUPAC Name:(5-cyano-2-fluorophenyl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate
Traditional Name:4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid (5-cyano-2-fluoro-benzyl) ester
Formula: C17H14FNO2S
MolecularWeight: 315.361963
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)OCC3=C(C=CC(=C3)C#N)F


Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)OCC3=C(C=CC(=C3)C#N)F


InChI

InChI=1S/C17H14FNO2S/c18-14-6-5-11(9-19)7-13(14)10-21-17(20)16-8-12-3-1-2-4-15(12)22-16/h5-8H,1-4,10H2


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