[3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-chromen-7-yl] (2R)-oxolane-2-carboxylate

Systemtic Name: [3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-chromen-7-yl] (2R)-oxolane-2-carboxylate Openeye Name: [3-(4-chloro-3,5-dimethyl-phenoxy)-4-oxo-chromen-7-yl] (2R)-tetrahydrofuran-2-carboxylate CAS Name: (2R)-2-oxolanecarboxylic acid [3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-chloro-3,5-dimethylphenoxy)-4-oxochromen-7-yl] (2R)-oxolane-2-carboxylate Traditional Name: (2R)-tetrahydrofuran-2-carboxylic acid [3-(4-chloro-3,5-dimethyl-phenoxy)-4-keto-chromen-7-yl] ester Formula: C22H19ClO6 MolecularWeight: 414.83566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4CCCO4

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)[C@H]4CCCO4

InChI

InChI=1S/C22H19ClO6/c1-12-8-15(9-13(2)20(12)23)28-19-11-27-18-10-14(5-6-16(18)21(19)24)29-22(25)17-4-3-7-26-17/h5-6,8-11,17H,3-4,7H2,1-2H3/t17-/m1/s1