3-[3-(5-methyl-2-propan-2-yl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoic acid

Systemtic Name: 3-[3-(5-methyl-2-propan-2-yl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoic acid Openeye Name: 3-[3-(2-isopropyl-5-methyl-phenoxy)-4-oxo-chromen-7-yl]oxypropanoic acid CAS Name: 3-[[3-(5-methyl-2-propan-2-ylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]propanoic acid IUPAC Name: 3-[3-(5-methyl-2-propan-2-ylphenoxy)-4-oxochromen-7-yl]oxypropanoic acid Traditional Name: 3-[3-(2-isopropyl-5-methyl-phenoxy)-4-keto-chromen-7-yl]oxypropionic acid Formula: C22H22O6 MolecularWeight: 382.40648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O6/c1-13(2)16-6-4-14(3)10-19(16)28-20-12-27-18-11-15(26-9-8-21(23)24)5-7-17(18)22(20)25/h4-7,10-13H,8-9H2,1-3H3,(H,23,24)