2-[4-(furan-2-ylmethyl)piperazin-1-yl]benzoic acid

Systemtic Name: 2-[4-(furan-2-ylmethyl)piperazin-1-yl]benzoic acid Openeye Name: 2-[4-(2-furylmethyl)piperazin-1-yl]benzoic acid CAS Name: 2-[4-(2-furanylmethyl)-1-piperazinyl]benzoic acid IUPAC Name: 2-[4-(furan-2-ylmethyl)piperazin-1-yl]benzoic acid Traditional Name: 2-[4-(2-furfuryl)piperazino]benzoic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CO2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CO2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C16H18N2O3/c19-16(20)14-5-1-2-6-15(14)18-9-7-17(8-10-18)12-13-4-3-11-21-13/h1-6,11H,7-10,12H2,(H,19,20)