ethyl 4-fluoranyl-3-[(4-methoxy-2-nitro-phenoxy)methyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[(4-methoxy-2-nitro-phenoxy)methyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[(4-methoxy-2-nitro-phenoxy)methyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[(4-methoxy-2-nitrophenoxy)methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[(4-methoxy-2-nitrophenoxy)methyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[(4-methoxy-2-nitro-phenoxy)methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C19H16FNO6S MolecularWeight: 405.396843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H16FNO6S/c1-3-26-19(22)18-12(17-13(20)5-4-6-16(17)28-18)10-27-15-8-7-11(25-2)9-14(15)21(23)24/h4-9H,3,10H2,1-2H3