2,5-dimethyl-4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-3-one

Systemtic Name: 2,5-dimethyl-4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-3-one Openeye Name: 2,5-dimethyl-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-3-one CAS Name: 2,5-dimethyl-4-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1H-pyrazol-3-one IUPAC Name: 2,5-dimethyl-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazol-3-one Traditional Name: 4-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-2,5-dimethyl-3-pyrazolin-3-one Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C)C=C2C=CC(=O)C=C2

Isomeric SMILES

CC1=C(C(=O)N(N1)C)C=C2C=CC(=O)C=C2

InChI

InChI=1S/C12H12N2O2/c1-8-11(12(16)14(2)13-8)7-9-3-5-10(15)6-4-9/h3-7,13H,1-2H3