(E)-4-oxidanylidene-4-(pyridin-3-ylmethylcarbamoylamino)but-2-enoate

Systemtic Name: (E)-4-oxidanylidene-4-(pyridin-3-ylmethylcarbamoylamino)but-2-enoate Openeye Name: (E)-4-oxo-4-(3-pyridylmethylcarbamoylamino)but-2-enoate CAS Name: (E)-4-oxo-4-[[oxo-(3-pyridinylmethylamino)methyl]amino]-2-butenoate IUPAC Name: (E)-4-oxo-4-(pyridin-3-ylmethylcarbamoylamino)but-2-enoate Traditional Name: (E)-4-keto-4-(3-pyridylmethylcarbamoylamino)but-2-enoate Formula: C11H10N3O4- MolecularWeight: 248.2148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)NC(=O)C=CC(=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)NC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C11H11N3O4/c15-9(3-4-10(16)17)14-11(18)13-7-8-2-1-5-12-6-8/h1-6H,7H2,(H,16,17)(H2,13,14,15,18)/p-1/b4-3+