8-chloranyl-6-[(E)-oct-1-enyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

Systemtic Name: 8-chloranyl-6-[(E)-oct-1-enyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Openeye Name: 8-chloro-6-[(E)-oct-1-enyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid CAS Name: 8-chloro-6-[(E)-oct-1-enyl]-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 8-chloro-6-[(E)-oct-1-enyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Traditional Name: 8-chloro-6-[(E)-oct-1-enyl]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Formula: C19H20ClF3O3 MolecularWeight: 388.80851

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1=CC(=C2C(=C1)C=C(C(O2)C(F)(F)F)C(=O)O)Cl

Isomeric SMILES

CCCCCC/C=C/C1=CC(=C2C(=C1)C=C(C(O2)C(F)(F)F)C(=O)O)Cl

InChI

InChI=1S/C19H20ClF3O3/c1-2-3-4-5-6-7-8-12-9-13-11-14(18(24)25)17(19(21,22)23)26-16(13)15(20)10-12/h7-11,17H,2-6H2,1H3,(H,24,25)/b8-7+