5-(piperazin-4-ium-1-ylmethyl)furan-2-carboxylate

Systemtic Name: 5-(piperazin-4-ium-1-ylmethyl)furan-2-carboxylate Openeye Name: 5-(piperazin-4-ium-1-ylmethyl)furan-2-carboxylate CAS Name: 5-(1-piperazin-4-iumylmethyl)-2-furancarboxylate IUPAC Name: 5-(piperazin-4-ium-1-ylmethyl)furan-2-carboxylate Traditional Name: 5-(piperazin-4-ium-1-ylmethyl)-2-furoate Formula: C10H14N2O3 MolecularWeight: 210.22976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C10H14N2O3/c13-10(14)9-2-1-8(15-9)7-12-5-3-11-4-6-12/h1-2,11H,3-7H2,(H,13,14)