4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-morpholin-4-yl-6-nitro-quinoline-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-morpholin-4-yl-6-nitro-quinoline-3-carbonitrile Openeye Name: 4-(3-chloro-4-fluoro-anilino)-7-morpholino-6-nitro-quinoline-3-carbonitrile CAS Name: 4-(3-chloro-4-fluoroanilino)-7-(4-morpholinyl)-6-nitro-3-quinolinecarbonitrile IUPAC Name: 4-(3-chloro-4-fluoroanilino)-7-morpholin-4-yl-6-nitroquinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-fluoro-anilino)-7-morpholino-6-nitro-quinoline-3-carbonitrile Formula: C20H15ClFN5O3 MolecularWeight: 427.816203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C3C(=C2)N=CC(=C3NC4=CC(=C(C=C4)F)Cl)C#N)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C3C(=C2)N=CC(=C3NC4=CC(=C(C=C4)F)Cl)C#N)[N+](=O)[O-]

InChI

InChI=1S/C20H15ClFN5O3/c21-15-7-13(1-2-16(15)22)25-20-12(10-23)11-24-17-9-18(26-3-5-30-6-4-26)19(27(28)29)8-14(17)20/h1-2,7-9,11H,3-6H2,(H,24,25)