(E)-4-[[2-cyanoethyl(methyl)carbamoyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[2-cyanoethyl(methyl)carbamoyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[2-cyanoethyl(methyl)carbamoyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[[2-cyanoethyl(methyl)amino]-oxomethyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[2-cyanoethyl(methyl)carbamoyl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[2-cyanoethyl(methyl)carbamoyl]amino]-4-keto-but-2-enoic acid Formula: C9H11N3O4 MolecularWeight: 225.20134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

CN(CCC#N)C(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C9H11N3O4/c1-12(6-2-5-10)9(16)11-7(13)3-4-8(14)15/h3-4H,2,6H2,1H3,(H,14,15)(H,11,13,16)/b4-3+