(E)-4-oxidanylidene-4-(prop-2-ynylcarbamoylamino)but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(prop-2-ynylcarbamoylamino)but-2-enoic acid Openeye Name: (E)-4-oxo-4-(prop-2-ynylcarbamoylamino)but-2-enoic acid CAS Name: (E)-4-oxo-4-[[oxo-(prop-2-ynylamino)methyl]amino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(prop-2-ynylcarbamoylamino)but-2-enoic acid Traditional Name: (E)-4-keto-4-(propargylcarbamoylamino)but-2-enoic acid Formula: C8H8N2O4 MolecularWeight: 196.16012

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

C#CCNC(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C8H8N2O4/c1-2-5-9-8(14)10-6(11)3-4-7(12)13/h1,3-4H,5H2,(H,12,13)(H2,9,10,11,14)/b4-3+