(E)-4-oxidanylidene-4-(1-phenylethylcarbamoylamino)but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(1-phenylethylcarbamoylamino)but-2-enoic acid Openeye Name: (E)-4-oxo-4-(1-phenylethylcarbamoylamino)but-2-enoic acid CAS Name: (E)-4-oxo-4-[[oxo-(1-phenylethylamino)methyl]amino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(1-phenylethylcarbamoylamino)but-2-enoic acid Traditional Name: (E)-4-keto-4-(1-phenylethylcarbamoylamino)but-2-enoic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O4/c1-9(10-5-3-2-4-6-10)14-13(19)15-11(16)7-8-12(17)18/h2-9H,1H3,(H,17,18)(H2,14,15,16,19)/b8-7+