2-[(E)-4-diethoxyphosphorylbut-2-enyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[(E)-4-diethoxyphosphorylbut-2-enyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[(E)-4-diethoxyphosphorylbut-2-enyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[(E)-4-diethoxyphosphorylbut-2-enyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[(E)-4-diethoxyphosphorylbut-2-enyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[(E)-4-diethoxyphosphorylbut-2-enyl]-1,2,4-triazine-3,5-quinone Formula: C11H18N3O5P MolecularWeight: 303.251481

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC=CCN1C(=O)NC(=O)C=N1)OCC

Isomeric SMILES

CCOP(=O)(C/C=C/CN1C(=O)NC(=O)C=N1)OCC

InChI

InChI=1S/C11H18N3O5P/c1-3-18-20(17,19-4-2)8-6-5-7-14-11(16)13-10(15)9-12-14/h5-6,9H,3-4,7-8H2,1-2H3,(H,13,15,16)/b6-5+