2-[8-chloranyl-3-oxidanyl-4-oxidanylidene-2-(4-propan-2-ylphenyl)chromen-6-yl]ethanoic acid

Systemtic Name: 2-[8-chloranyl-3-oxidanyl-4-oxidanylidene-2-(4-propan-2-ylphenyl)chromen-6-yl]ethanoic acid Openeye Name: 2-[8-chloro-3-hydroxy-2-(4-isopropylphenyl)-4-oxo-chromen-6-yl]acetic acid CAS Name: 2-[8-chloro-3-hydroxy-4-oxo-2-(4-propan-2-ylphenyl)-1-benzopyran-6-yl]acetic acid IUPAC Name: 2-[8-chloro-3-hydroxy-4-oxo-2-(4-propan-2-ylphenyl)chromen-6-yl]acetic acid Traditional Name: 2-(8-chloro-3-hydroxy-4-keto-2-p-cumenyl-chromen-6-yl)acetic acid Formula: C20H17ClO5 MolecularWeight: 372.79898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(C(=O)C3=CC(=CC(=C3O2)Cl)CC(=O)O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(C(=O)C3=CC(=CC(=C3O2)Cl)CC(=O)O)O

InChI

InChI=1S/C20H17ClO5/c1-10(2)12-3-5-13(6-4-12)19-18(25)17(24)14-7-11(9-16(22)23)8-15(21)20(14)26-19/h3-8,10,25H,9H2,1-2H3,(H,22,23)