5-[[4-[(5-carboxyfuran-2-yl)methyl]piperazin-1-yl]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[4-[(5-carboxyfuran-2-yl)methyl]piperazin-1-yl]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[(5-carboxy-2-furyl)methyl]piperazin-1-yl]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[(5-carboxy-2-furanyl)methyl]-1-piperazinyl]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[(5-carboxyfuran-2-yl)methyl]piperazin-1-yl]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[(5-carboxy-2-furyl)methyl]piperazino]methyl]-2-furoic acid Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(O2)C(=O)O)CC3=CC=C(O3)C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(O2)C(=O)O)CC3=CC=C(O3)C(=O)O

InChI

InChI=1S/C16H18N2O6/c19-15(20)13-3-1-11(23-13)9-17-5-7-18(8-6-17)10-12-2-4-14(24-12)16(21)22/h1-4H,5-10H2,(H,19,20)(H,21,22)