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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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