2-[4-(5-bromanylthiophen-3-yl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(5-bromanylthiophen-3-yl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(5-bromothiophene-3-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(5-bromo-3-thiophenyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(5-bromothiophene-3-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(5-bromothiophene-3-carbonyl)piperazino]acetic acid Formula: C11H13BrN2O3S MolecularWeight: 333.20152

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)C2=CSC(=C2)Br

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)C2=CSC(=C2)Br

InChI

InChI=1S/C11H13BrN2O3S/c12-9-5-8(7-18-9)11(17)14-3-1-13(2-4-14)6-10(15)16/h5,7H,1-4,6H2,(H,15,16)