(3E)-3-[6,7-bis(oxidanylidene)cyclohepta-2,4-dien-1-ylidene]-2-methyl-1H-pyrazole-5-carboxylic acid

Systemtic Name: (3E)-3-[6,7-bis(oxidanylidene)cyclohepta-2,4-dien-1-ylidene]-2-methyl-1H-pyrazole-5-carboxylic acid Openeye Name: (3E)-3-(6,7-dioxocyclohepta-2,4-dien-1-ylidene)-2-methyl-1H-pyrazole-5-carboxylic acid CAS Name: (3E)-3-(6,7-dioxo-1-cyclohepta-2,4-dienylidene)-2-methyl-1H-pyrazole-5-carboxylic acid IUPAC Name: (3E)-3-(6,7-dioxocyclohepta-2,4-dien-1-ylidene)-2-methyl-1H-pyrazole-5-carboxylic acid Traditional Name: (5E)-5-(6,7-diketocyclohepta-2,4-dien-1-ylidene)-1-methyl-3-pyrazoline-3-carboxylic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C=CC=CC(=O)C2=O)C=C(N1)C(=O)O

Isomeric SMILES

CN1/C(=C/2\C=CC=CC(=O)C2=O)/C=C(N1)C(=O)O

InChI

InChI=1S/C12H10N2O4/c1-14-9(6-8(13-14)12(17)18)7-4-2-3-5-10(15)11(7)16/h2-6,13H,1H3,(H,17,18)/b9-7+