(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2,3,6-tris(chloranyl)benzoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2,3,6-tris(chloranyl)benzoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 2,3,6-trichlorobenzoate CAS Name: 2,3,6-trichlorobenzoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 2,3,6-trichlorobenzoate Traditional Name: 2,3,6-trichlorobenzoic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H17Cl3O4 MolecularWeight: 439.71628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=C(C=CC(=C3Cl)Cl)Cl)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=C(C=CC(=C3Cl)Cl)Cl)C(C)C

InChI

InChI=1S/C21H17Cl3O4/c1-10(2)13-8-14-12(7-18(25)28-17(14)6-11(13)3)9-27-21(26)19-15(22)4-5-16(23)20(19)24/h4-8,10H,9H2,1-3H3