2-(chloromethyl)-4-diethoxyphosphinothioyloxy-phthalazin-1-one

Systemtic Name: 2-(chloromethyl)-4-diethoxyphosphinothioyloxy-phthalazin-1-one Openeye Name: 2-(chloromethyl)-4-diethoxyphosphinothioyloxy-phthalazin-1-one CAS Name: 2-(chloromethyl)-4-diethoxyphosphinothioyloxy-1-phthalazinone IUPAC Name: 2-(chloromethyl)-4-diethoxyphosphinothioyloxyphthalazin-1-one Traditional Name: 2-(chloromethyl)-4-diethoxythiophosphoryloxy-phthalazin-1-one Formula: C13H16ClN2O4PS MolecularWeight: 362.768901

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)OC1=NN(C(=O)C2=CC=CC=C21)CCl

Isomeric SMILES

CCOP(=S)(OCC)OC1=NN(C(=O)C2=CC=CC=C21)CCl

InChI

InChI=1S/C13H16ClN2O4PS/c1-3-18-21(22,19-4-2)20-12-10-7-5-6-8-11(10)13(17)16(9-14)15-12/h5-8H,3-4,9H2,1-2H3