(3E)-3-(1,3-dimethyl-5-oxidanylidene-pyrazol-4-ylidene)cyclobutane-1,2-dione

Systemtic Name: (3E)-3-(1,3-dimethyl-5-oxidanylidene-pyrazol-4-ylidene)cyclobutane-1,2-dione Openeye Name: (3E)-3-(1,3-dimethyl-5-oxo-pyrazol-4-ylidene)cyclobutane-1,2-dione CAS Name: (3E)-3-(1,3-dimethyl-5-oxo-4-pyrazolylidene)cyclobutane-1,2-dione IUPAC Name: (3E)-3-(1,3-dimethyl-5-oxopyrazol-4-ylidene)cyclobutane-1,2-dione Traditional Name: (3E)-3-(5-keto-1,3-dimethyl-2-pyrazolin-4-ylidene)cyclobutane-1,2-quinone Formula: C9H8N2O3 MolecularWeight: 192.17142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C2CC(=O)C2=O)C

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/2\CC(=O)C2=O)C

InChI

InChI=1S/C9H8N2O3/c1-4-7(9(14)11(2)10-4)5-3-6(12)8(5)13/h3H2,1-2H3/b7-5+