2-[3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylphenyl]ethanoic acid

Systemtic Name: 2-[3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylphenyl]ethanoic acid Openeye Name: 2-[3-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylphenyl]acetic acid CAS Name: 2-[3-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]phenyl]acetic acid IUPAC Name: 2-[3-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylphenyl]acetic acid Traditional Name: 2-[3-[4-(2-furoyl)piperazino]sulfonylphenyl]acetic acid Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CO2)S(=O)(=O)C3=CC=CC(=C3)CC(=O)O

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CO2)S(=O)(=O)C3=CC=CC(=C3)CC(=O)O

InChI

InChI=1S/C17H18N2O6S/c20-16(21)12-13-3-1-4-14(11-13)26(23,24)19-8-6-18(7-9-19)17(22)15-5-2-10-25-15/h1-5,10-11H,6-9,12H2,(H,20,21)