(2R)-2-[4-oxidanylidene-3-(3-propan-2-ylphenoxy)chromen-7-yl]oxypropanoic acid

Systemtic Name: (2R)-2-[4-oxidanylidene-3-(3-propan-2-ylphenoxy)chromen-7-yl]oxypropanoic acid Openeye Name: (2R)-2-[3-(3-isopropylphenoxy)-4-oxo-chromen-7-yl]oxypropanoic acid CAS Name: (2R)-2-[[4-oxo-3-(3-propan-2-ylphenoxy)-1-benzopyran-7-yl]oxy]propanoic acid IUPAC Name: (2R)-2-[4-oxo-3-(3-propan-2-ylphenoxy)chromen-7-yl]oxypropanoic acid Traditional Name: (2R)-2-[3-(3-isopropylphenoxy)-4-keto-chromen-7-yl]oxypropionic acid Formula: C21H20O6 MolecularWeight: 368.3799

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC(=C3)C(C)C

InChI

InChI=1S/C21H20O6/c1-12(2)14-5-4-6-15(9-14)27-19-11-25-18-10-16(26-13(3)21(23)24)7-8-17(18)20(19)22/h4-13H,1-3H3,(H,23,24)/t13-/m1/s1