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

Systemtic Name: ethyl (5E)-5-[6,7-bis(oxidanylidene)cyclohepta-2,4-dien-1-ylidene]-2-methyl-1H-pyrazole-3-carboxylate Openeye Name: ethyl (5E)-5-(6,7-dioxocyclohepta-2,4-dien-1-ylidene)-2-methyl-1H-pyrazole-3-carboxylate CAS Name: (5E)-5-(6,7-dioxo-1-cyclohepta-2,4-dienylidene)-2-methyl-1H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-(6,7-dioxocyclohepta-2,4-dien-1-ylidene)-2-methyl-1H-pyrazole-3-carboxylate Traditional Name: (5E)-5-(6,7-diketocyclohepta-2,4-dien-1-ylidene)-2-methyl-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2C=CC=CC(=O)C2=O)NN1C

Isomeric SMILES

CCOC(=O)C1=C/C(=C\2/C=CC=CC(=O)C2=O)/NN1C

InChI

InChI=1S/C14H14N2O4/c1-3-20-14(19)11-8-10(15-16(11)2)9-6-4-5-7-12(17)13(9)18/h4-8,15H,3H2,1-2H3/b10-9+