(E)-4-oxidanylidene-4-(propylcarbamoylamino)but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(propylcarbamoylamino)but-2-enoic acid Openeye Name: (E)-4-oxo-4-(propylcarbamoylamino)but-2-enoic acid CAS Name: (E)-4-oxo-4-[[oxo(propylamino)methyl]amino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(propylcarbamoylamino)but-2-enoic acid Traditional Name: (E)-4-keto-4-(propylcarbamoylamino)but-2-enoic acid Formula: C8H12N2O4 MolecularWeight: 200.19188

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

CCCNC(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C8H12N2O4/c1-2-5-9-8(14)10-6(11)3-4-7(12)13/h3-4H,2,5H2,1H3,(H,12,13)(H2,9,10,11,14)/b4-3+