3-chloranyl-4-methyl-7-oxidanyl-chromen-2-one; dipropyl phosphate

Systemtic Name: 3-chloranyl-4-methyl-7-oxidanyl-chromen-2-one; dipropyl phosphate Openeye Name: 3-chloro-7-hydroxy-4-methyl-chromen-2-one; dipropyl phosphate CAS Name: 3-chloro-7-hydroxy-4-methyl-1-benzopyran-2-one; dipropyl phosphate IUPAC Name: 3-chloro-7-hydroxy-4-methylchromen-2-one; dipropyl phosphate Traditional Name: 3-chloro-7-hydroxy-4-methyl-coumarin; dipropyl phosphate Formula: C16H21ClO7P- MolecularWeight: 391.760501

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Descriptors Computed from Structure

Canonical SMILES:

CCCOP(=O)([O-])OCCC.CC1=C(C(=O)OC2=C1C=CC(=C2)O)Cl

Isomeric SMILES

CCCOP(=O)([O-])OCCC.CC1=C(C(=O)OC2=C1C=CC(=C2)O)Cl

InChI

InChI=1S/C10H7ClO3.C6H15O4P/c1-5-7-3-2-6(12)4-8(7)14-10(13)9(5)11;1-3-5-9-11(7,8)10-6-4-2/h2-4,12H,1H3;3-6H2,1-2H3,(H,7,8)/p-1