1-[(3-bromophenyl)-(5-chloranylthiophen-2-yl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3-bromophenyl)-(5-chloranylthiophen-2-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-bromophenyl)-(5-chloro-2-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-bromophenyl)-(5-chloro-2-thiophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-bromophenyl)-(5-chlorothiophen-2-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-bromophenyl)-(5-chloro-2-thienyl)methyl]pipecolinic acid Formula: C17H17BrClNO2S MolecularWeight: 414.74438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)Br)C3=CC=C(S3)Cl

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)Br)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H17BrClNO2S/c18-12-5-3-4-11(10-12)16(14-7-8-15(19)23-14)20-9-2-1-6-13(20)17(21)22/h3-5,7-8,10,13,16H,1-2,6,9H2,(H,21,22)