5-[[2-cyanoethyl(methyl)amino]methyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[[2-cyanoethyl(methyl)amino]methyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[[2-cyanoethyl(methyl)amino]methyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[[2-cyanoethyl(methyl)amino]methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[[2-cyanoethyl(methyl)amino]methyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[[2-cyanoethyl(methyl)amino]methyl]-2-methyl-3-furoic acid Formula: C11H14N2O3 MolecularWeight: 222.24046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN(C)CCC#N)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CN(C)CCC#N)C(=O)O

InChI

InChI=1S/C11H14N2O3/c1-8-10(11(14)15)6-9(16-8)7-13(2)5-3-4-12/h6H,3,5,7H2,1-2H3,(H,14,15)