ethyl 1-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)piperidine-3-carboxylate CAS Name: 1-[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)piperidine-3-carboxylate Traditional Name: 1-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)nipecotic acid ethyl ester Formula: C17H17ClFNO3S MolecularWeight: 369.838183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C17H17ClFNO3S/c1-2-23-17(22)10-4-3-7-20(9-10)16(21)15-14(18)12-6-5-11(19)8-13(12)24-15/h5-6,8,10H,2-4,7,9H2,1H3