1-[(2-bromophenyl)-(furan-2-yl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(2-bromophenyl)-(furan-2-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2-bromophenyl)-(2-furyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2-bromophenyl)-(2-furanyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2-bromophenyl)-(furan-2-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2-bromophenyl)-(2-furyl)methyl]pipecolinic acid Formula: C17H18BrNO3 MolecularWeight: 364.23372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC=CC=C2Br)C3=CC=CO3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC=CC=C2Br)C3=CC=CO3

InChI

InChI=1S/C17H18BrNO3/c18-13-7-2-1-6-12(13)16(15-9-5-11-22-15)19-10-4-3-8-14(19)17(20)21/h1-2,5-7,9,11,14,16H,3-4,8,10H2,(H,20,21)