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

Systemtic Name: 2-[4-(5-ethylfuran-2-yl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(5-ethylfuran-2-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(5-ethyl-2-furanyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(5-ethylfuran-2-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(5-ethyl-2-furoyl)piperazino]acetic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CCC1=CC=C(O1)C(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C13H18N2O4/c1-2-10-3-4-11(19-10)13(18)15-7-5-14(6-8-15)9-12(16)17/h3-4H,2,5-9H2,1H3,(H,16,17)