5-[[2-cyanoethyl(phenyl)amino]methyl]furan-2-carboxylate

Systemtic Name: 5-[[2-cyanoethyl(phenyl)amino]methyl]furan-2-carboxylate Openeye Name: 5-[[N-(2-cyanoethyl)anilino]methyl]furan-2-carboxylate CAS Name: 5-[[N-(2-cyanoethyl)anilino]methyl]-2-furancarboxylate IUPAC Name: 5-[[N-(2-cyanoethyl)anilino]methyl]furan-2-carboxylate Traditional Name: 5-[[N-(2-cyanoethyl)anilino]methyl]-2-furoate Formula: C15H13N2O3- MolecularWeight: 269.27532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)CC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)CC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C15H14N2O3/c16-9-4-10-17(12-5-2-1-3-6-12)11-13-7-8-14(20-13)15(18)19/h1-3,5-8H,4,10-11H2,(H,18,19)/p-1