6-bromanyl-2-[2-(diethoxyphosphorylmethoxy)ethyl]-4-prop-2-enyl-1,2,4-triazine-3,5-dione

Systemtic Name: 6-bromanyl-2-[2-(diethoxyphosphorylmethoxy)ethyl]-4-prop-2-enyl-1,2,4-triazine-3,5-dione Openeye Name: 4-allyl-6-bromo-2-[2-(diethoxyphosphorylmethoxy)ethyl]-1,2,4-triazine-3,5-dione CAS Name: 6-bromo-2-[2-(diethoxyphosphorylmethoxy)ethyl]-4-prop-2-enyl-1,2,4-triazine-3,5-dione IUPAC Name: 6-bromo-2-[2-(diethoxyphosphorylmethoxy)ethyl]-4-prop-2-enyl-1,2,4-triazine-3,5-dione Traditional Name: 4-allyl-6-bromo-2-[2-(diethoxyphosphorylmethoxy)ethyl]-1,2,4-triazine-3,5-quinone Formula: C13H21BrN3O6P MolecularWeight: 426.200101

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COCCN1C(=O)N(C(=O)C(=N1)Br)CC=C)OCC

Isomeric SMILES

CCOP(=O)(COCCN1C(=O)N(C(=O)C(=N1)Br)CC=C)OCC

InChI

InChI=1S/C13H21BrN3O6P/c1-4-7-16-12(18)11(14)15-17(13(16)19)8-9-21-10-24(20,22-5-2)23-6-3/h4H,1,5-10H2,2-3H3