5-chloranyl-7-[(S)-pyrrolidin-1-ium-1-yl-[4-(trifluoromethyl)phenyl]methyl]quinolin-8-ol

Systemtic Name: 5-chloranyl-7-[(S)-pyrrolidin-1-ium-1-yl-[4-(trifluoromethyl)phenyl]methyl]quinolin-8-ol Openeye Name: 5-chloro-7-[(S)-pyrrolidin-1-ium-1-yl-[4-(trifluoromethyl)phenyl]methyl]quinolin-8-ol CAS Name: 5-chloro-7-[(S)-1-pyrrolidin-1-iumyl-[4-(trifluoromethyl)phenyl]methyl]-8-quinolinol IUPAC Name: 5-chloro-7-[(S)-pyrrolidin-1-ium-1-yl-[4-(trifluoromethyl)phenyl]methyl]quinolin-8-ol Traditional Name: 5-chloro-7-[(S)-pyrrolidin-1-ium-1-yl-[4-(trifluoromethyl)phenyl]methyl]quinolin-8-ol Formula: C21H19ClF3N2O+ MolecularWeight: 407.83657

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

C1CC[NH+](C1)[C@@H](C2=CC=C(C=C2)C(F)(F)F)C3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C21H18ClF3N2O/c22-17-12-16(20(28)18-15(17)4-3-9-26-18)19(27-10-1-2-11-27)13-5-7-14(8-6-13)21(23,24)25/h3-9,12,19,28H,1-2,10-11H2/p+1/t19-/m0/s1