N-(3,4-dimethoxyphenyl)-6-fluoranyl-quinolin-1-ium-4-amine

Systemtic Name: N-(3,4-dimethoxyphenyl)-6-fluoranyl-quinolin-1-ium-4-amine Openeye Name: N-(3,4-dimethoxyphenyl)-6-fluoro-quinolin-1-ium-4-amine CAS Name: N-(3,4-dimethoxyphenyl)-6-fluoro-4-quinolin-1-iumamine IUPAC Name: N-(3,4-dimethoxyphenyl)-6-fluoroquinolin-1-ium-4-amine Traditional Name: (3,4-dimethoxyphenyl)-(6-fluoroquinolin-1-ium-4-yl)amine Formula: C17H16FN2O2+ MolecularWeight: 299.319543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C3C=C(C=CC3=[NH+]C=C2)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C3C=C(C=CC3=[NH+]C=C2)F)OC

InChI

InChI=1S/C17H15FN2O2/c1-21-16-6-4-12(10-17(16)22-2)20-15-7-8-19-14-5-3-11(18)9-13(14)15/h3-10H,1-2H3,(H,19,20)/p+1