2-[3,5-bis(oxidanylidene)-4-phenyl-1,2,4-triazolidin-1-yl]-2-methyl-propanal

Systemtic Name: 2-[3,5-bis(oxidanylidene)-4-phenyl-1,2,4-triazolidin-1-yl]-2-methyl-propanal Openeye Name: 2-(3,5-dioxo-4-phenyl-1,2,4-triazolidin-1-yl)-2-methyl-propanal CAS Name: 2-(3,5-dioxo-4-phenyl-1,2,4-triazolidin-1-yl)-2-methylpropanal IUPAC Name: 2-(3,5-dioxo-4-phenyl-1,2,4-triazolidin-1-yl)-2-methylpropanal Traditional Name: 2-(3,5-diketo-4-phenyl-1,2,4-triazolidin-1-yl)-2-methyl-propionaldehyde Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=O)N1C(=O)N(C(=O)N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C=O)N1C(=O)N(C(=O)N1)C2=CC=CC=C2

InChI

InChI=1S/C12H13N3O3/c1-12(2,8-16)15-11(18)14(10(17)13-15)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,13,17)