1-[4,5-bis(bromanyl)thiophen-2-yl]carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-[4,5-bis(bromanyl)thiophen-2-yl]carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(4,5-dibromothiophene-2-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[(4,5-dibromo-2-thiophenyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(4,5-dibromothiophene-2-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(4,5-dibromothiophene-2-carbonyl)nipecotic acid Formula: C11H11Br2NO3S MolecularWeight: 397.08294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=C(S2)Br)Br)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC(=C(S2)Br)Br)C(=O)O

InChI

InChI=1S/C11H11Br2NO3S/c12-7-4-8(18-9(7)13)10(15)14-3-1-2-6(5-14)11(16)17/h4,6H,1-3,5H2,(H,16,17)