(4-nitrophenyl)methyl 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid (4-nitrobenzyl) ester Formula: C16H10FNO4S MolecularWeight: 331.318303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C16H10FNO4S/c17-13-2-1-3-14-12(13)8-15(23-14)16(19)22-9-10-4-6-11(7-5-10)18(20)21/h1-8H,9H2