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

Systemtic Name: N-[2-[(7-chloranylquinolin-1-ium-4-yl)amino]ethyl]-2-fluoranyl-benzamide Openeye Name: N-[2-[(7-chloroquinolin-1-ium-4-yl)amino]ethyl]-2-fluoro-benzamide CAS Name: N-[2-[(7-chloro-4-quinolin-1-iumyl)amino]ethyl]-2-fluorobenzamide IUPAC Name: N-[2-[(7-chloroquinolin-1-ium-4-yl)amino]ethyl]-2-fluorobenzamide Traditional Name: N-[2-[(7-chloroquinolin-1-ium-4-yl)amino]ethyl]-2-fluoro-benzamide Formula: C18H16ClFN3O+ MolecularWeight: 344.790543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCNC2=C3C=CC(=CC3=[NH+]C=C2)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCNC2=C3C=CC(=CC3=[NH+]C=C2)Cl)F

InChI

InChI=1S/C18H15ClFN3O/c19-12-5-6-14-16(7-8-21-17(14)11-12)22-9-10-23-18(24)13-3-1-2-4-15(13)20/h1-8,11H,9-10H2,(H,21,22)(H,23,24)/p+1