5-chloranyl-3-diethoxyphosphoryl-6-methyl-1-(5-phenylselanylpentyl)pyrazin-2-one

Systemtic Name: 5-chloranyl-3-diethoxyphosphoryl-6-methyl-1-(5-phenylselanylpentyl)pyrazin-2-one Openeye Name: 5-chloro-3-diethoxyphosphoryl-6-methyl-1-(5-phenylselanylpentyl)pyrazin-2-one CAS Name: 5-chloro-3-diethoxyphosphoryl-6-methyl-1-[5-(phenylseleno)pentyl]-2-pyrazinone IUPAC Name: 5-chloro-3-diethoxyphosphoryl-6-methyl-1-(5-phenylselanylpentyl)pyrazin-2-one Traditional Name: 5-chloro-3-diethoxyphosphoryl-6-methyl-1-[5-(phenylseleno)pentyl]pyrazin-2-one Formula: C20H28ClN2O4PSe MolecularWeight: 505.834081

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=NC(=C(N(C1=O)CCCCC[Se]C2=CC=CC=C2)C)Cl)OCC

Isomeric SMILES

CCOP(=O)(C1=NC(=C(N(C1=O)CCCCC[Se]C2=CC=CC=C2)C)Cl)OCC

InChI

InChI=1S/C20H28ClN2O4PSe/c1-4-26-28(25,27-5-2)19-20(24)23(16(3)18(21)22-19)14-10-7-11-15-29-17-12-8-6-9-13-17/h6,8-9,12-13H,4-5,7,10-11,14-15H2,1-3H3