3-[[bis(cyanomethyl)amino]methyl]furan-2-carboxylic acid

Systemtic Name: 3-[[bis(cyanomethyl)amino]methyl]furan-2-carboxylic acid Openeye Name: 3-[[bis(cyanomethyl)amino]methyl]furan-2-carboxylic acid CAS Name: 3-[[bis(cyanomethyl)amino]methyl]-2-furancarboxylic acid IUPAC Name: 3-[[bis(cyanomethyl)amino]methyl]furan-2-carboxylic acid Traditional Name: 3-[[bis(cyanomethyl)amino]methyl]-2-furoic acid Formula: C10H9N3O3 MolecularWeight: 219.19676

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1CN(CC#N)CC#N)C(=O)O

Isomeric SMILES

C1=COC(=C1CN(CC#N)CC#N)C(=O)O

InChI

InChI=1S/C10H9N3O3/c11-2-4-13(5-3-12)7-8-1-6-16-9(8)10(14)15/h1,6H,4-5,7H2,(H,14,15)