tert-butyl 2-[3-(4-chlorophenyl)-4-methyl-2-oxidanylidene-chromen-7-yl]oxyethanoate

Systemtic Name: tert-butyl 2-[3-(4-chlorophenyl)-4-methyl-2-oxidanylidene-chromen-7-yl]oxyethanoate Openeye Name: tert-butyl 2-[3-(4-chlorophenyl)-4-methyl-2-oxo-chromen-7-yl]oxyacetate CAS Name: 2-[[3-(4-chlorophenyl)-4-methyl-2-oxo-1-benzopyran-7-yl]oxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-(4-chlorophenyl)-4-methyl-2-oxochromen-7-yl]oxyacetate Traditional Name: 2-[3-(4-chlorophenyl)-2-keto-4-methyl-chromen-7-yl]oxyacetic acid tert-butyl ester Formula: C22H21ClO5 MolecularWeight: 400.85214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)OC(C)(C)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)OC(C)(C)C)C3=CC=C(C=C3)Cl

InChI

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