sodium (3E)-6-oxidanylidene-3-[[(2S)-1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: sodium (3E)-6-oxidanylidene-3-[[(2S)-1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: sodium (3E)-3-[[(1S)-1-benzyl-2-hydroxy-2-oxo-ethyl]hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: sodium (3E)-3-[[(2S)-1-hydroxy-1-oxo-3-phenylpropan-2-yl]hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: sodium (3E)-3-[[(2S)-1-hydroxy-1-oxo-3-phenylpropan-2-yl]hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylic acid Traditional Name: sodium (3E)-3-[[(1S)-1-benzyl-2-hydroxy-2-keto-ethyl]hydrazono]-6-keto-cyclohexa-1,4-diene-1-carboxylic acid Formula: C16H14N2NaO5+ MolecularWeight: 337.28253

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NN=C2C=CC(=O)C(=C2)C(=O)O.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)N/N=C/2\C=CC(=O)C(=C2)C(=O)O.[Na+]

InChI

InChI=1S/C16H14N2O5.Na/c19-14-7-6-11(9-12(14)15(20)21)17-18-13(16(22)23)8-10-4-2-1-3-5-10;/h1-7,9,13,18H,8H2,(H,20,21)(H,22,23);/q;+1/b17-11+;/t13-;/m0./s1