methyl 1-[2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyloxy]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyloxy]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)oxyacetyl]isonipecotic acid methyl ester Formula: C18H17ClFNO5S MolecularWeight: 413.847683

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)COC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)COC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C18H17ClFNO5S/c1-25-17(23)10-4-6-21(7-5-10)14(22)9-26-18(24)16-15(19)12-3-2-11(20)8-13(12)27-16/h2-3,8,10H,4-7,9H2,1H3