4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-ethoxy-quinoline-3-carbonitrile hydrochloride

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-ethoxy-quinoline-3-carbonitrile hydrochloride Openeye Name: 4-(3-chloro-4-fluoro-anilino)-6-ethoxy-quinoline-3-carbonitrile hydrochloride CAS Name: 4-(3-chloro-4-fluoroanilino)-6-ethoxy-3-quinolinecarbonitrile hydrochloride IUPAC Name: 4-(3-chloro-4-fluoroanilino)-6-ethoxyquinoline-3-carbonitrile hydrochloride Traditional Name: 4-(3-chloro-4-fluoro-anilino)-6-ethoxy-quinoline-3-carbonitrile hydrochloride Formula: C18H14Cl2FN3O MolecularWeight: 378.227663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC(=C(C=C3)F)Cl.Cl

Isomeric SMILES

CCOC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC(=C(C=C3)F)Cl.Cl

InChI

InChI=1S/C18H13ClFN3O.ClH/c1-2-24-13-4-6-17-14(8-13)18(11(9-21)10-22-17)23-12-3-5-16(20)15(19)7-12;/h3-8,10H,2H2,1H3,(H,22,23);1H