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

Systemtic Name: 2-[4-(5-bromanylfuran-2-yl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(5-bromo-2-furanyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(5-bromo-2-furoyl)piperazino]acetic acid Formula: C11H13BrN2O4 MolecularWeight: 317.13592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)C2=CC=C(O2)Br

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C11H13BrN2O4/c12-9-2-1-8(18-9)11(17)14-5-3-13(4-6-14)7-10(15)16/h1-2H,3-7H2,(H,15,16)