N-[4-[(7-chloranylquinolin-1-ium-4-yl)amino]butyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[(7-chloranylquinolin-1-ium-4-yl)amino]butyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[(7-chloroquinolin-1-ium-4-yl)amino]butyl]-2-fluoro-benzamide CAS Name: N-[4-[(7-chloro-4-quinolin-1-iumyl)amino]butyl]-2-fluorobenzamide IUPAC Name: N-[4-[(7-chloroquinolin-1-ium-4-yl)amino]butyl]-2-fluorobenzamide Traditional Name: N-[4-[(7-chloroquinolin-1-ium-4-yl)amino]butyl]-2-fluoro-benzamide Formula: C20H20ClFN3O+ MolecularWeight: 372.843703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCCCNC2=C3C=CC(=CC3=[NH+]C=C2)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCCCNC2=C3C=CC(=CC3=[NH+]C=C2)Cl)F

InChI

InChI=1S/C20H19ClFN3O/c21-14-7-8-16-18(9-12-24-19(16)13-14)23-10-3-4-11-25-20(26)15-5-1-2-6-17(15)22/h1-2,5-9,12-13H,3-4,10-11H2,(H,23,24)(H,25,26)/p+1