methyl (2R)-2-(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxy-2-phenyl-ethanoate

Systemtic Name: methyl (2R)-2-(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxy-2-phenyl-ethanoate Openeye Name: methyl (2R)-2-(6-chloro-2-oxo-4-propyl-chromen-7-yl)oxy-2-phenyl-acetate CAS Name: (2R)-2-[(6-chloro-2-oxo-4-propyl-1-benzopyran-7-yl)oxy]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2R)-2-(6-chloro-2-oxo-4-propylchromen-7-yl)oxy-2-phenylacetate Traditional Name: (2R)-2-(6-chloro-2-keto-4-propyl-chromen-7-yl)oxy-2-phenyl-acetic acid methyl ester Formula: C21H19ClO5 MolecularWeight: 386.82556

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)O[C@H](C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H19ClO5/c1-3-7-14-10-19(23)26-17-12-18(16(22)11-15(14)17)27-20(21(24)25-2)13-8-5-4-6-9-13/h4-6,8-12,20H,3,7H2,1-2H3/t20-/m1/s1