1-[(2-fluorophenyl)-thiophen-3-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2-fluorophenyl)-thiophen-3-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2-fluorophenyl)-(3-thienyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-fluorophenyl)-(3-thiophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-fluorophenyl)-thiophen-3-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2-fluorophenyl)-(3-thienyl)methyl]isonipecotic acid Formula: C17H18FNO2S MolecularWeight: 319.393723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CSC=C2)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CSC=C2)C3=CC=CC=C3F

InChI

InChI=1S/C17H18FNO2S/c18-15-4-2-1-3-14(15)16(13-7-10-22-11-13)19-8-5-12(6-9-19)17(20)21/h1-4,7,10-12,16H,5-6,8-9H2,(H,20,21)