3-[7-[(3,4-dichlorophenyl)methoxy]-4,8-dimethyl-2-oxidanylidene-chromen-3-yl]propanoic acid

Systemtic Name: 3-[7-[(3,4-dichlorophenyl)methoxy]-4,8-dimethyl-2-oxidanylidene-chromen-3-yl]propanoic acid Openeye Name: 3-[7-[(3,4-dichlorophenyl)methoxy]-4,8-dimethyl-2-oxo-chromen-3-yl]propanoic acid CAS Name: 3-[7-[(3,4-dichlorophenyl)methoxy]-4,8-dimethyl-2-oxo-1-benzopyran-3-yl]propanoic acid IUPAC Name: 3-[7-[(3,4-dichlorophenyl)methoxy]-4,8-dimethyl-2-oxochromen-3-yl]propanoic acid Traditional Name: 3-[7-(3,4-dichlorobenzyl)oxy-2-keto-4,8-dimethyl-chromen-3-yl]propionic acid Formula: C21H18Cl2O5 MolecularWeight: 421.27062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=CC(=C(C=C3)Cl)Cl)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=CC(=C(C=C3)Cl)Cl)CCC(=O)O

InChI

InChI=1S/C21H18Cl2O5/c1-11-14-4-7-18(27-10-13-3-6-16(22)17(23)9-13)12(2)20(14)28-21(26)15(11)5-8-19(24)25/h3-4,6-7,9H,5,8,10H2,1-2H3,(H,24,25)