1-[(4-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperidine-4-carboxylic acid Openeye Name: 1-(4-fluorobenzothiophene-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(4-fluoro-1-benzothiophen-2-yl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(4-fluoro-1-benzothiophene-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(4-fluorobenzothiophene-2-carbonyl)isonipecotic acid Formula: C15H14FNO3S MolecularWeight: 307.339963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C15H14FNO3S/c16-11-2-1-3-12-10(11)8-13(21-12)14(18)17-6-4-9(5-7-17)15(19)20/h1-3,8-9H,4-7H2,(H,19,20)