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

Systemtic Name: 2-[2-(4-tert-butylphenyl)-6-chloranyl-7-methyl-4-oxidanylidene-chromen-3-yl]oxypropanoic acid Openeye Name: 2-[2-(4-tert-butylphenyl)-6-chloro-7-methyl-4-oxo-chromen-3-yl]oxypropanoic acid CAS Name: 2-[[2-(4-tert-butylphenyl)-6-chloro-7-methyl-4-oxo-1-benzopyran-3-yl]oxy]propanoic acid IUPAC Name: 2-[2-(4-tert-butylphenyl)-6-chloro-7-methyl-4-oxochromen-3-yl]oxypropanoic acid Traditional Name: 2-[2-(4-tert-butylphenyl)-6-chloro-4-keto-7-methyl-chromen-3-yl]oxypropionic acid Formula: C23H23ClO5 MolecularWeight: 414.87872

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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)C(C)(C)C)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClO5/c1-12-10-18-16(11-17(12)24)19(25)21(28-13(2)22(26)27)20(29-18)14-6-8-15(9-7-14)23(3,4)5/h6-11,13H,1-5H3,(H,26,27)