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

Systemtic Name: 1-[(4-bromophenyl)-(3-fluorophenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-bromophenyl)-(3-fluorophenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-bromophenyl)-(3-fluorophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-bromophenyl)-(3-fluorophenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-bromophenyl)-(3-fluorophenyl)methyl]pipecolinic acid Formula: C19H19BrFNO2 MolecularWeight: 392.262063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC=C(C=C2)Br)C3=CC(=CC=C3)F

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC=C(C=C2)Br)C3=CC(=CC=C3)F

InChI

InChI=1S/C19H19BrFNO2/c20-15-9-7-13(8-10-15)18(14-4-3-5-16(21)12-14)22-11-2-1-6-17(22)19(23)24/h3-5,7-10,12,17-18H,1-2,6,11H2,(H,23,24)