6-chloranyl-8-(3-methoxyphenyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-chloranyl-8-(3-methoxyphenyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-chloro-8-(3-methoxyphenyl)-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-chloro-8-(3-methoxyphenyl)-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-chloro-8-(3-methoxyphenyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-chloro-8-(3-methoxyphenyl)-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C18H14ClF3O4 MolecularWeight: 386.74957

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=CC3=C2OC(C(C3)C(=O)O)C(F)(F)F)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=CC3=C2OC(C(C3)C(=O)O)C(F)(F)F)Cl

InChI

InChI=1S/C18H14ClF3O4/c1-25-12-4-2-3-9(6-12)13-8-11(19)5-10-7-14(17(23)24)16(18(20,21)22)26-15(10)13/h2-6,8,14,16H,7H2,1H3,(H,23,24)