3-[3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonylpyrazol-1-yl]propanoic acid

Systemtic Name: 3-[3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonylpyrazol-1-yl]propanoic acid Openeye Name: 3-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[3-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[3-[4-(2-furoyl)piperazine-1-carbonyl]pyrazol-1-yl]propionic acid Formula: C16H18N4O5 MolecularWeight: 346.33792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NN(C=C2)CCC(=O)O)C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CCN1C(=O)C2=NN(C=C2)CCC(=O)O)C(=O)C3=CC=CO3

InChI

InChI=1S/C16H18N4O5/c21-14(22)4-6-20-5-3-12(17-20)15(23)18-7-9-19(10-8-18)16(24)13-2-1-11-25-13/h1-3,5,11H,4,6-10H2,(H,21,22)