(E)-4-oxidanylidene-4-(pentan-2-ylcarbamoylamino)but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(pentan-2-ylcarbamoylamino)but-2-enoic acid Openeye Name: (E)-4-(1-methylbutylcarbamoylamino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-[[oxo-(pentan-2-ylamino)methyl]amino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(pentan-2-ylcarbamoylamino)but-2-enoic acid Traditional Name: (E)-4-keto-4-(1-methylbutylcarbamoylamino)but-2-enoic acid Formula: C10H16N2O4 MolecularWeight: 228.24504

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

CCCC(C)NC(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C10H16N2O4/c1-3-4-7(2)11-10(16)12-8(13)5-6-9(14)15/h5-7H,3-4H2,1-2H3,(H,14,15)(H2,11,12,13,16)/b6-5+