5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-6-(2-oxidanylidenepropyl)-2H-1,2,4-triazin-3-one

Systemtic Name: 5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-6-(2-oxidanylidenepropyl)-2H-1,2,4-triazin-3-one Openeye Name: 6-acetonyl-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-1,2,4-triazin-3-one CAS Name: 5-(4-oxo-1-cyclohexa-2,5-dienylidene)-6-(2-oxopropyl)-2H-1,2,4-triazin-3-one IUPAC Name: 5-(4-oxocyclohexa-2,5-dien-1-ylidene)-6-(2-oxopropyl)-2H-1,2,4-triazin-3-one Traditional Name: 6-acetonyl-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-2H-1,2,4-triazin-3-one Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=NNC(=O)NC1=C2C=CC(=O)C=C2

Isomeric SMILES

CC(=O)CC1=NNC(=O)NC1=C2C=CC(=O)C=C2

InChI

InChI=1S/C12H11N3O3/c1-7(16)6-10-11(13-12(18)15-14-10)8-2-4-9(17)5-3-8/h2-5H,6H2,1H3,(H2,13,15,18)