5-chloranyl-7-[(S)-(4-fluorophenyl)-piperidin-1-ium-1-yl-methyl]quinolin-8-ol

Systemtic Name: 5-chloranyl-7-[(S)-(4-fluorophenyl)-piperidin-1-ium-1-yl-methyl]quinolin-8-ol Openeye Name: 5-chloro-7-[(S)-(4-fluorophenyl)-piperidin-1-ium-1-yl-methyl]quinolin-8-ol CAS Name: 5-chloro-7-[(S)-(4-fluorophenyl)-(1-piperidin-1-iumyl)methyl]-8-quinolinol IUPAC Name: 5-chloro-7-[(S)-(4-fluorophenyl)-piperidin-1-ium-1-ylmethyl]quinolin-8-ol Traditional Name: 5-chloro-7-[(S)-(4-fluorophenyl)-piperidin-1-ium-1-yl-methyl]quinolin-8-ol Formula: C21H21ClFN2O+ MolecularWeight: 371.855643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(C2=CC=C(C=C2)F)C3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](C2=CC=C(C=C2)F)C3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C21H20ClFN2O/c22-18-13-17(21(26)19-16(18)5-4-10-24-19)20(25-11-2-1-3-12-25)14-6-8-15(23)9-7-14/h4-10,13,20,26H,1-3,11-12H2/p+1/t20-/m0/s1