(5E)-5-(4-methyl-3-oxidanylidene-piperazin-2-ylidene)-6-oxidanylidene-cyclohexa-1,3-diene-1-carboxylic acid

Systemtic Name: (5E)-5-(4-methyl-3-oxidanylidene-piperazin-2-ylidene)-6-oxidanylidene-cyclohexa-1,3-diene-1-carboxylic acid Openeye Name: (5E)-5-(4-methyl-3-oxo-piperazin-2-ylidene)-6-oxo-cyclohexa-1,3-diene-1-carboxylic acid CAS Name: (5E)-5-(4-methyl-3-oxo-2-piperazinylidene)-6-oxo-1-cyclohexa-1,3-dienecarboxylic acid IUPAC Name: (5E)-5-(4-methyl-3-oxopiperazin-2-ylidene)-6-oxocyclohexa-1,3-diene-1-carboxylic acid Traditional Name: (5E)-6-keto-5-(3-keto-4-methyl-piperazin-2-ylidene)cyclohexa-1,3-diene-1-carboxylic acid Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNC(=C2C=CC=C(C2=O)C(=O)O)C1=O

Isomeric SMILES

CN1CCN/C(=C/2\C=CC=C(C2=O)C(=O)O)/C1=O

InChI

InChI=1S/C12H12N2O4/c1-14-6-5-13-9(11(14)16)7-3-2-4-8(10(7)15)12(17)18/h2-4,13H,5-6H2,1H3,(H,17,18)/b9-7+