6-chloranyl-8-(4-methoxycarbonylphenyl)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

Systemtic Name: 6-chloranyl-8-(4-methoxycarbonylphenyl)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Openeye Name: 6-chloro-8-(4-methoxycarbonylphenyl)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid CAS Name: 6-chloro-8-(4-methoxycarbonylphenyl)-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-chloro-8-(4-methoxycarbonylphenyl)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Traditional Name: 8-(4-carbomethoxyphenyl)-6-chloro-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Formula: C19H12ClF3O5 MolecularWeight: 412.74379

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC(=CC3=C2OC(C(=C3)C(=O)O)C(F)(F)F)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC(=CC3=C2OC(C(=C3)C(=O)O)C(F)(F)F)Cl

InChI

InChI=1S/C19H12ClF3O5/c1-27-18(26)10-4-2-9(3-5-10)13-8-12(20)6-11-7-14(17(24)25)16(19(21,22)23)28-15(11)13/h2-8,16H,1H3,(H,24,25)