methyl (2S)-2-[3-(4-bromophenyl)-4-methyl-2-oxidanylidene-chromen-6-yl]oxypropanoate

Systemtic Name: methyl (2S)-2-[3-(4-bromophenyl)-4-methyl-2-oxidanylidene-chromen-6-yl]oxypropanoate Openeye Name: methyl (2S)-2-[3-(4-bromophenyl)-4-methyl-2-oxo-chromen-6-yl]oxypropanoate CAS Name: (2S)-2-[[3-(4-bromophenyl)-4-methyl-2-oxo-1-benzopyran-6-yl]oxy]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-(4-bromophenyl)-4-methyl-2-oxochromen-6-yl]oxypropanoate Traditional Name: (2S)-2-[3-(4-bromophenyl)-2-keto-4-methyl-chromen-6-yl]oxypropionic acid methyl ester Formula: C20H17BrO5 MolecularWeight: 417.24998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C(C=C2)O[C@@H](C)C(=O)OC)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H17BrO5/c1-11-16-10-15(25-12(2)19(22)24-3)8-9-17(16)26-20(23)18(11)13-4-6-14(21)7-5-13/h4-10,12H,1-3H3/t12-/m0/s1