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

Systemtic Name: 2-[4-(2,5-dimethylfuran-3-yl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(2,5-dimethyl-3-furanyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(2,5-dimethyl-3-furoyl)piperazino]acetic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C13H18N2O4/c1-9-7-11(10(2)19-9)13(18)15-5-3-14(4-6-15)8-12(16)17/h7H,3-6,8H2,1-2H3,(H,16,17)