4-(5-chloranyl-2-oxidanyl-3-prop-2-enyl-phenyl)-3-(2-hydroxyethyl)-1-methyl-6-(trifluoromethyl)quinolin-2-one

Systemtic Name: 4-(5-chloranyl-2-oxidanyl-3-prop-2-enyl-phenyl)-3-(2-hydroxyethyl)-1-methyl-6-(trifluoromethyl)quinolin-2-one Openeye Name: 4-(3-allyl-5-chloro-2-hydroxy-phenyl)-3-(2-hydroxyethyl)-1-methyl-6-(trifluoromethyl)quinolin-2-one CAS Name: 4-(5-chloro-2-hydroxy-3-prop-2-enylphenyl)-3-(2-hydroxyethyl)-1-methyl-6-(trifluoromethyl)-2-quinolinone IUPAC Name: 4-(5-chloro-2-hydroxy-3-prop-2-enylphenyl)-3-(2-hydroxyethyl)-1-methyl-6-(trifluoromethyl)quinolin-2-one Traditional Name: 4-(3-allyl-5-chloro-2-hydroxy-phenyl)-3-(2-hydroxyethyl)-1-methyl-6-(trifluoromethyl)carbostyril Formula: C22H19ClF3NO3 MolecularWeight: 437.83937

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(F)(F)F)C(=C(C1=O)CCO)C3=CC(=CC(=C3O)CC=C)Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(F)(F)F)C(=C(C1=O)CCO)C3=CC(=CC(=C3O)CC=C)Cl

InChI

InChI=1S/C22H19ClF3NO3/c1-3-4-12-9-14(23)11-17(20(12)29)19-15(7-8-28)21(30)27(2)18-6-5-13(10-16(18)19)22(24,25)26/h3,5-6,9-11,28-29H,1,4,7-8H2,2H3