3-(4-bromophenyl)-7-(3,3-dimethyl-2-oxidanylidene-butoxy)-2-methyl-chromen-4-one

Systemtic Name: 3-(4-bromophenyl)-7-(3,3-dimethyl-2-oxidanylidene-butoxy)-2-methyl-chromen-4-one Openeye Name: 3-(4-bromophenyl)-7-(3,3-dimethyl-2-oxo-butoxy)-2-methyl-chromen-4-one CAS Name: 3-(4-bromophenyl)-7-(3,3-dimethyl-2-oxobutoxy)-2-methyl-1-benzopyran-4-one IUPAC Name: 3-(4-bromophenyl)-7-(3,3-dimethyl-2-oxobutoxy)-2-methylchromen-4-one Traditional Name: 3-(4-bromophenyl)-7-(2-keto-3,3-dimethyl-butoxy)-2-methyl-chromone Formula: C22H21BrO4 MolecularWeight: 429.30374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)C(C)(C)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)C(C)(C)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H21BrO4/c1-13-20(14-5-7-15(23)8-6-14)21(25)17-10-9-16(11-18(17)27-13)26-12-19(24)22(2,3)4/h5-11H,12H2,1-4H3