O4-[(2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[(2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[(2-ethoxycarbonyl-4-fluoro-benzothiophen-3-yl)methyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[(2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl] ester O1-ethyl ester IUPAC Name: 4-O-[(2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[(2-carbethoxy-4-fluoro-benzothiophen-3-yl)methyl] ester O1-ethyl ester Formula: C18H17FO6S MolecularWeight: 380.387383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC1=C(SC2=CC=CC(=C21)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC1=C(SC2=CC=CC(=C21)F)C(=O)OCC

InChI

InChI=1S/C18H17FO6S/c1-3-23-14(20)8-9-15(21)25-10-11-16-12(19)6-5-7-13(16)26-17(11)18(22)24-4-2/h5-9H,3-4,10H2,1-2H3/b9-8+