7-[bis(1,1,2,2,2-pentadeuterioethoxy)phosphinothioyloxy]-3-chloranyl-4-methyl-chromen-2-one

Systemtic Name: 7-[bis(1,1,2,2,2-pentadeuterioethoxy)phosphinothioyloxy]-3-chloranyl-4-methyl-chromen-2-one Openeye Name: 7-[bis(1,1,2,2,2-pentadeuterioethoxy)phosphinothioyloxy]-3-chloro-4-methyl-chromen-2-one CAS Name: 7-[bis(1,1,2,2,2-pentadeuterioethoxy)phosphinothioyloxy]-3-chloro-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[bis(1,1,2,2,2-pentadeuterioethoxy)phosphinothioyloxy]-3-chloro-4-methylchromen-2-one Traditional Name: 7-[bis(1,1,2,2,2-pentadeuterioethoxy)thiophosphoryloxy]-3-chloro-4-methyl-coumarin Formula: C14H16ClO5PS MolecularWeight: 372.827219

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)C

Isomeric SMILES

[2H]C([2H])([2H])C([2H])([2H])OP(=S)(OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)C)OC([2H])([2H])C([2H])([2H])[2H]

InChI

InChI=1S/C14H16ClO5PS/c1-4-17-21(22,18-5-2)20-10-6-7-11-9(3)13(15)14(16)19-12(11)8-10/h6-8H,4-5H2,1-3H3/i1D3,2D3,4D2,5D2