4-[4-oxidanylidene-3-(2,3,6-trimethylphenoxy)chromen-7-yl]oxybutanoic acid

Systemtic Name: 4-[4-oxidanylidene-3-(2,3,6-trimethylphenoxy)chromen-7-yl]oxybutanoic acid Openeye Name: 4-[4-oxo-3-(2,3,6-trimethylphenoxy)chromen-7-yl]oxybutanoic acid CAS Name: 4-[[4-oxo-3-(2,3,6-trimethylphenoxy)-1-benzopyran-7-yl]oxy]butanoic acid IUPAC Name: 4-[4-oxo-3-(2,3,6-trimethylphenoxy)chromen-7-yl]oxybutanoic acid Traditional Name: 4-[4-keto-3-(2,3,6-trimethylphenoxy)chromen-7-yl]oxybutyric acid Formula: C22H22O6 MolecularWeight: 382.40648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O6/c1-13-6-7-14(2)22(15(13)3)28-19-12-27-18-11-16(8-9-17(18)21(19)25)26-10-4-5-20(23)24/h6-9,11-12H,4-5,10H2,1-3H3,(H,23,24)