3-chloranyl-7-dimethoxyphosphinothioyloxy-4-methyl-chromen-2-one

Systemtic Name: 3-chloranyl-7-dimethoxyphosphinothioyloxy-4-methyl-chromen-2-one Openeye Name: 3-chloro-7-dimethoxyphosphinothioyloxy-4-methyl-chromen-2-one CAS Name: 3-chloro-7-dimethoxyphosphinothioyloxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-chloro-7-dimethoxyphosphinothioyloxy-4-methylchromen-2-one Traditional Name: 3-chloro-7-dimethoxythiophosphoryloxy-4-methyl-coumarin Formula: C12H12ClO5PS MolecularWeight: 334.712441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OP(=S)(OC)OC)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OP(=S)(OC)OC)Cl

InChI

InChI=1S/C12H12ClO5PS/c1-7-9-5-4-8(18-19(20,15-2)16-3)6-10(9)17-12(14)11(7)13/h4-6H,1-3H3