(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-chloranylphenoxy)-2-methyl-propanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-chloranylphenoxy)-2-methyl-propanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-(4-chlorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-chlorophenoxy)-2-methylpropanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-(4-chlorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-chlorophenoxy)-2-methyl-propionic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C22H21ClO5 MolecularWeight: 400.85214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C(C)(C)OC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C(C)(C)OC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H21ClO5/c1-13-9-18-15(11-20(24)27-19(18)10-14(13)2)12-26-21(25)22(3,4)28-17-7-5-16(23)6-8-17/h5-11H,12H2,1-4H3