(2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: (2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: (2-ethoxycarbonyl-4-fluoro-benzothiophen-3-yl)methyl 3-ethyl-5-methyl-isoxazole-4-carboxylate CAS Name: 3-ethyl-5-methyl-4-isoxazolecarboxylic acid (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl ester IUPAC Name: (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-ethyl-5-methyl-isoxazole-4-carboxylic acid (2-carbethoxy-4-fluoro-benzothiophen-3-yl)methyl ester Formula: C19H18FNO5S MolecularWeight: 391.413323

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)OCC2=C(SC3=CC=CC(=C32)F)C(=O)OCC)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)OCC2=C(SC3=CC=CC(=C32)F)C(=O)OCC)C

InChI

InChI=1S/C19H18FNO5S/c1-4-13-15(10(3)26-21-13)18(22)25-9-11-16-12(20)7-6-8-14(16)27-17(11)19(23)24-5-2/h6-8H,4-5,9H2,1-3H3