1-[(4-fluorophenyl)-(1H-pyrrol-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-fluorophenyl)-(1H-pyrrol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-fluorophenyl)-(1H-pyrrol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-fluorophenyl)-(1H-pyrrol-2-yl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-fluorophenyl)-(1H-pyrrol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-fluorophenyl)-(1H-pyrrol-2-yl)methyl]isonipecotic acid Formula: C17H19FN2O2 MolecularWeight: 302.343363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)F)C3=CC=CN3

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)F)C3=CC=CN3

InChI

InChI=1S/C17H19FN2O2/c18-14-5-3-12(4-6-14)16(15-2-1-9-19-15)20-10-7-13(8-11-20)17(21)22/h1-6,9,13,16,19H,7-8,10-11H2,(H,21,22)