(2S)-3-methyl-2-[4-oxidanylidene-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxy-butanoic acid

Systemtic Name: (2S)-3-methyl-2-[4-oxidanylidene-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxy-butanoic acid Openeye Name: (2S)-3-methyl-2-[4-oxo-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxy-butanoic acid CAS Name: (2S)-3-methyl-2-[[4-oxo-3-(2,3,5-trimethylphenoxy)-1-benzopyran-7-yl]oxy]butanoic acid IUPAC Name: (2S)-3-methyl-2-[4-oxo-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxybutanoic acid Traditional Name: (2S)-2-[4-keto-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxy-3-methyl-butyric acid Formula: C23H24O6 MolecularWeight: 396.43306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(C(C)C)C(=O)O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=COC3=C(C2=O)C=CC(=C3)O[C@@H](C(C)C)C(=O)O)C)C

InChI

InChI=1S/C23H24O6/c1-12(2)22(23(25)26)28-16-6-7-17-19(10-16)27-11-20(21(17)24)29-18-9-13(3)8-14(4)15(18)5/h6-12,22H,1-5H3,(H,25,26)/t22-/m0/s1