(E)-4-oxidanylidene-4-[(3-oxidanylidenepiperazin-1-yl)carbonylamino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[(3-oxidanylidenepiperazin-1-yl)carbonylamino]but-2-enoic acid Openeye Name: (E)-4-oxo-4-[(3-oxopiperazine-1-carbonyl)amino]but-2-enoic acid CAS Name: (E)-4-oxo-4-[[oxo-(3-oxo-1-piperazinyl)methyl]amino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-[(3-oxopiperazine-1-carbonyl)amino]but-2-enoic acid Traditional Name: (E)-4-keto-4-[(3-ketopiperazine-1-carbonyl)amino]but-2-enoic acid Formula: C9H11N3O5 MolecularWeight: 241.20074

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

C1CN(CC(=O)N1)C(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C9H11N3O5/c13-6(1-2-8(15)16)11-9(17)12-4-3-10-7(14)5-12/h1-2H,3-5H2,(H,10,14)(H,15,16)(H,11,13,17)/b2-1+