1-[[5-(5-bromanylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[[5-(5-bromanylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl]piperidine-3-carboxylic acid Openeye Name: 1-[[5-(5-bromo-2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]piperidine-3-carboxylic acid CAS Name: 1-[[5-(5-bromo-2-thiophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[[5-(5-bromothiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl]piperidine-3-carboxylic acid Traditional Name: 1-[[5-(5-bromo-2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]nipecotic acid Formula: C13H14BrN3O3S MolecularWeight: 372.23756

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=NN=C(O2)C3=CC=C(S3)Br)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC2=NN=C(O2)C3=CC=C(S3)Br)C(=O)O

InChI

InChI=1S/C13H14BrN3O3S/c14-10-4-3-9(21-10)12-16-15-11(20-12)7-17-5-1-2-8(6-17)13(18)19/h3-4,8H,1-2,5-7H2,(H,18,19)