4-azanyl-1-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 4-azanyl-1-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]pyrrolidine-2,4-dicarboxylic acid Openeye Name: 4-amino-1-[(E)-4-hydroxy-4-oxo-but-2-enoyl]pyrrolidine-2,4-dicarboxylic acid CAS Name: 4-amino-1-[(E)-4-hydroxy-1,4-dioxobut-2-enyl]pyrrolidine-2,4-dicarboxylic acid IUPAC Name: 4-amino-1-[(E)-4-hydroxy-4-oxobut-2-enoyl]pyrrolidine-2,4-dicarboxylic acid Traditional Name: 4-amino-1-[(E)-4-hydroxy-4-keto-but-2-enoyl]pyrrolidine-2,4-dicarboxylic acid Formula: C10H12N2O7 MolecularWeight: 272.21148

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC1(C(=O)O)N)C(=O)C=CC(=O)O)C(=O)O

Isomeric SMILES

C1C(N(CC1(C(=O)O)N)C(=O)/C=C/C(=O)O)C(=O)O

InChI

InChI=1S/C10H12N2O7/c11-10(9(18)19)3-5(8(16)17)12(4-10)6(13)1-2-7(14)15/h1-2,5H,3-4,11H2,(H,14,15)(H,16,17)(H,18,19)/b2-1+