6-fluoranyl-4-[(3,4,5-trimethoxyphenyl)amino]quinoline-3-carbonitrile hydrochloride

Systemtic Name: 6-fluoranyl-4-[(3,4,5-trimethoxyphenyl)amino]quinoline-3-carbonitrile hydrochloride Openeye Name: 6-fluoro-4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile hydrochloride CAS Name: 6-fluoro-4-(3,4,5-trimethoxyanilino)-3-quinolinecarbonitrile hydrochloride IUPAC Name: 6-fluoro-4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile hydrochloride Traditional Name: 6-fluoro-4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile hydrochloride Formula: C19H17ClFN3O3 MolecularWeight: 389.807983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=C3C=C(C=CC3=NC=C2C#N)F.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=C3C=C(C=CC3=NC=C2C#N)F.Cl

InChI

InChI=1S/C19H16FN3O3.ClH/c1-24-16-7-13(8-17(25-2)19(16)26-3)23-18-11(9-21)10-22-15-5-4-12(20)6-14(15)18;/h4-8,10H,1-3H3,(H,22,23);1H