6-chloranyl-3-ethanoyl-4-(3-phenylprop-2-ynylamino)-8-(trifluoromethyl)-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-3-ethanoyl-4-(3-phenylprop-2-ynylamino)-8-(trifluoromethyl)-1H-quinolin-2-one Openeye Name: 3-acetyl-6-chloro-4-(3-phenylprop-2-ynylamino)-8-(trifluoromethyl)-1H-quinolin-2-one CAS Name: 3-acetyl-6-chloro-4-(3-phenylprop-2-ynylamino)-8-(trifluoromethyl)-1H-quinolin-2-one IUPAC Name: 3-acetyl-6-chloro-4-(3-phenylprop-2-ynylamino)-8-(trifluoromethyl)-1H-quinolin-2-one Traditional Name: 3-acetyl-6-chloro-4-(3-phenylprop-2-ynylamino)-8-(trifluoromethyl)carbostyril Formula: C21H14ClF3N2O2 MolecularWeight: 418.79627

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=CC(=CC(=C2NC1=O)C(F)(F)F)Cl)NCC#CC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=C(C2=CC(=CC(=C2NC1=O)C(F)(F)F)Cl)NCC#CC3=CC=CC=C3

InChI

InChI=1S/C21H14ClF3N2O2/c1-12(28)17-19(26-9-5-8-13-6-3-2-4-7-13)15-10-14(22)11-16(21(23,24)25)18(15)27-20(17)29/h2-4,6-7,10-11H,9H2,1H3,(H2,26,27,29)