2-[4-(7-chloranyl-4-oxidanylidene-chromen-2-yl)-2,6-dimethyl-phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-(7-chloranyl-4-oxidanylidene-chromen-2-yl)-2,6-dimethyl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-(7-chloro-4-oxo-chromen-2-yl)-2,6-dimethyl-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-(7-chloro-4-oxo-1-benzopyran-2-yl)-2,6-dimethylphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-(7-chloro-4-oxochromen-2-yl)-2,6-dimethylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-(7-chloro-4-keto-chromen-2-yl)-2,6-dimethyl-phenoxy]-2-methyl-propionic acid Formula: C21H19ClO5 MolecularWeight: 386.82556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)(C)C(=O)O)C)C2=CC(=O)C3=C(O2)C=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OC(C)(C)C(=O)O)C)C2=CC(=O)C3=C(O2)C=C(C=C3)Cl

InChI

InChI=1S/C21H19ClO5/c1-11-7-13(8-12(2)19(11)27-21(3,4)20(24)25)17-10-16(23)15-6-5-14(22)9-18(15)26-17/h5-10H,1-4H3,(H,24,25)