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

Systemtic Name: 1-[(2-chlorophenyl)-(1H-pyrrol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2-chlorophenyl)-(1H-pyrrol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-chlorophenyl)-(1H-pyrrol-2-yl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-chlorophenyl)-(1H-pyrrol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2-chlorophenyl)-(1H-pyrrol-2-yl)methyl]isonipecotic acid Formula: C17H19ClN2O2 MolecularWeight: 318.79796

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC=CC=C2Cl)C3=CC=CN3

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=CC=C2Cl)C3=CC=CN3

InChI

InChI=1S/C17H19ClN2O2/c18-14-5-2-1-4-13(14)16(15-6-3-9-19-15)20-10-7-12(8-11-20)17(21)22/h1-6,9,12,16,19H,7-8,10-11H2,(H,21,22)