[2-(hexylamino)-2-oxidanylidene-ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(hexylamino)-2-oxidanylidene-ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(hexylamino)-2-oxo-ethyl] 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid [2-(hexylamino)-2-oxoethyl] ester IUPAC Name: [2-(hexylamino)-2-oxoethyl] 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid [2-(hexylamino)-2-keto-ethyl] ester Formula: C17H20FNO3S MolecularWeight: 337.409003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)COC(=O)C1=CC2=C(C=CC=C2S1)F

Isomeric SMILES

CCCCCCNC(=O)COC(=O)C1=CC2=C(C=CC=C2S1)F

InChI

InChI=1S/C17H20FNO3S/c1-2-3-4-5-9-19-16(20)11-22-17(21)15-10-12-13(18)7-6-8-14(12)23-15/h6-8,10H,2-5,9,11H2,1H3,(H,19,20)