ethyl 4-fluoranyl-3-[(6-methyl-2-nitro-pyridin-3-yl)oxymethyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[(6-methyl-2-nitro-pyridin-3-yl)oxymethyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[(6-methyl-2-nitro-3-pyridyl)oxymethyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[(6-methyl-2-nitro-3-pyridinyl)oxymethyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[(6-methyl-2-nitropyridin-3-yl)oxymethyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[(6-methyl-2-nitro-3-pyridyl)oxymethyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C18H15FN2O5S MolecularWeight: 390.385503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15FN2O5S/c1-3-25-18(22)16-11(15-12(19)5-4-6-14(15)27-16)9-26-13-8-7-10(2)20-17(13)21(23)24/h4-8H,3,9H2,1-2H3