[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 5-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 5-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(2,4-dimethoxyanilino)-2-oxo-ethyl] 5-fluorobenzothiophene-2-carboxylate CAS Name: 5-fluoro-1-benzothiophene-2-carboxylic acid [2-(2,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyanilino)-2-oxoethyl] 5-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 5-fluorobenzothiophene-2-carboxylic acid [2-(2,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C19H16FNO5S MolecularWeight: 389.397443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC3=C(S2)C=CC(=C3)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC3=C(S2)C=CC(=C3)F)OC

InChI

InChI=1S/C19H16FNO5S/c1-24-13-4-5-14(15(9-13)25-2)21-18(22)10-26-19(23)17-8-11-7-12(20)3-6-16(11)27-17/h3-9H,10H2,1-2H3,(H,21,22)