2-[6-chloranyl-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl]oxypropanoic acid

Systemtic Name: 2-[6-chloranyl-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl]oxypropanoic acid Openeye Name: 2-[6-chloro-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-chromen-3-yl]oxypropanoic acid CAS Name: 2-[[6-chloro-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-1-benzopyran-3-yl]oxy]propanoic acid IUPAC Name: 2-[6-chloro-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxochromen-3-yl]oxypropanoic acid Traditional Name: 2-[6-chloro-2-(3,4-dimethoxyphenyl)-4-keto-7-methyl-chromen-3-yl]oxypropionic acid Formula: C21H19ClO7 MolecularWeight: 418.82436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(C)C(=O)O)C3=CC(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(C)C(=O)O)C3=CC(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C21H19ClO7/c1-10-7-16-13(9-14(10)22)18(23)20(28-11(2)21(24)25)19(29-16)12-5-6-15(26-3)17(8-12)27-4/h5-9,11H,1-4H3,(H,24,25)