dibutyl (3-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) phosphate

Systemtic Name: dibutyl (3-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) phosphate Openeye Name: dibutyl (3-chloro-4-methyl-2-oxo-chromen-7-yl) phosphate CAS Name: phosphoric acid dibutyl (3-chloro-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: dibutyl (3-chloro-4-methyl-2-oxochromen-7-yl) phosphate Traditional Name: phosphoric acid dibutyl (3-chloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C18H24ClO6P MolecularWeight: 402.806321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(OCCCC)OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)C

Isomeric SMILES

CCCCOP(=O)(OCCCC)OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)C

InChI

InChI=1S/C18H24ClO6P/c1-4-6-10-22-26(21,23-11-7-5-2)25-14-8-9-15-13(3)17(19)18(20)24-16(15)12-14/h8-9,12H,4-7,10-11H2,1-3H3