(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-(4-chloranyl-3-methyl-phenoxy)butanoate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-(4-chloranyl-3-methyl-phenoxy)butanoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 4-(4-chloro-3-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3-methylphenoxy)butanoic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 4-(4-chloro-3-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-3-methyl-phenoxy)butyric acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C22H21ClO5 MolecularWeight: 400.85214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCOC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCOC3=CC(=C(C=C3)Cl)C

InChI

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