4-fluoranyl-3-(phenoxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: 4-fluoranyl-3-(phenoxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: 4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxylate IUPAC Name: 4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxylate Formula: C16H10FO3S- MolecularWeight: 301.312203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=C(SC3=CC=CC(=C32)F)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC2=C(SC3=CC=CC(=C32)F)C(=O)[O-]

InChI

InChI=1S/C16H11FO3S/c17-12-7-4-8-13-14(12)11(15(21-13)16(18)19)9-20-10-5-2-1-3-6-10/h1-8H,9H2,(H,18,19)/p-1