(E)-4-oxidanylidene-4-(pyridin-4-ylmethylcarbamoylamino)but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(pyridin-4-ylmethylcarbamoylamino)but-2-enoic acid Openeye Name: (E)-4-oxo-4-(4-pyridylmethylcarbamoylamino)but-2-enoic acid CAS Name: (E)-4-oxo-4-[[oxo-(pyridin-4-ylmethylamino)methyl]amino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(pyridin-4-ylmethylcarbamoylamino)but-2-enoic acid Traditional Name: (E)-4-keto-4-(4-pyridylmethylcarbamoylamino)but-2-enoic acid Formula: C11H11N3O4 MolecularWeight: 249.22274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CNC(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

C1=CN=CC=C1CNC(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C11H11N3O4/c15-9(1-2-10(16)17)14-11(18)13-7-8-3-5-12-6-4-8/h1-6H,7H2,(H,16,17)(H2,13,14,15,18)/b2-1+