2-(azaniumylmethyl)-5-phenyl-furan-3-carboxylate

Systemtic Name: 2-(azaniumylmethyl)-5-phenyl-furan-3-carboxylate Openeye Name: 2-(azaniumylmethyl)-5-phenyl-furan-3-carboxylate CAS Name: 2-(ammoniomethyl)-5-phenyl-3-furancarboxylate IUPAC Name: 2-(azaniumylmethyl)-5-phenylfuran-3-carboxylate Traditional Name: 2-(ammoniomethyl)-5-phenyl-3-furoate Formula: C12H11NO3 MolecularWeight: 217.22064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(O2)C[NH3+])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(O2)C[NH3+])C(=O)[O-]

InChI

InChI=1S/C12H11NO3/c13-7-11-9(12(14)15)6-10(16-11)8-4-2-1-3-5-8/h1-6H,7,13H2,(H,14,15)