4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-nitro-8-oxidanyl-quinoline-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-nitro-8-oxidanyl-quinoline-3-carbonitrile Openeye Name: 4-(3-chloro-4-fluoro-anilino)-8-hydroxy-6-nitro-quinoline-3-carbonitrile CAS Name: 4-(3-chloro-4-fluoroanilino)-8-hydroxy-6-nitro-3-quinolinecarbonitrile IUPAC Name: 4-(3-chloro-4-fluoroanilino)-8-hydroxy-6-nitroquinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-fluoro-anilino)-8-hydroxy-6-nitro-quinoline-3-carbonitrile Formula: C16H8ClFN4O3 MolecularWeight: 358.711123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C(C=NC3=C(C=C(C=C32)[N+](=O)[O-])O)C#N)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC2=C(C=NC3=C(C=C(C=C32)[N+](=O)[O-])O)C#N)Cl)F

InChI

InChI=1S/C16H8ClFN4O3/c17-12-3-9(1-2-13(12)18)21-15-8(6-19)7-20-16-11(15)4-10(22(24)25)5-14(16)23/h1-5,7,23H,(H,20,21)