5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxylate

Systemtic Name: 5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxylate Openeye Name: 5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxylate CAS Name: 5-(1-pyrrolidin-1-iumylmethyl)-2-furancarboxylate IUPAC Name: 5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxylate Traditional Name: 5-(pyrrolidin-1-ium-1-ylmethyl)-2-furoate Formula: C10H13NO3 MolecularWeight: 195.21512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C10H13NO3/c12-10(13)9-4-3-8(14-9)7-11-5-1-2-6-11/h3-4H,1-2,5-7H2,(H,12,13)