6-chloranyl-8-pent-1-ynyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-chloranyl-8-pent-1-ynyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-chloro-8-pent-1-ynyl-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-chloro-8-pent-1-ynyl-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-chloro-8-pent-1-ynyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-chloro-8-pent-1-ynyl-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C16H14ClF3O3 MolecularWeight: 346.72877

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC1=CC(=CC2=C1OC(C(C2)C(=O)O)C(F)(F)F)Cl

Isomeric SMILES

CCCC#CC1=CC(=CC2=C1OC(C(C2)C(=O)O)C(F)(F)F)Cl

InChI

InChI=1S/C16H14ClF3O3/c1-2-3-4-5-9-6-11(17)7-10-8-12(15(21)22)14(16(18,19)20)23-13(9)10/h6-7,12,14H,2-3,8H2,1H3,(H,21,22)