N-(3-chloranyl-4-cyano-phenyl)-7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-N-(3-chloro-4-cyano-phenyl)-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-N-(3-chloro-4-cyanophenyl)-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-N-(3-chloro-4-cyanophenyl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-N-(3-chloro-4-cyano-phenyl)-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxamide Formula: C25H23ClFN5O3 MolecularWeight: 495.933223

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NC4=CC(=C(C=C4)C#N)Cl

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NC4=CC(=C(C=C4)C#N)Cl

InChI

InChI=1S/C25H23ClFN5O3/c1-3-30-14-19(25(35)29-17-5-4-16(13-28)20(26)10-17)24(34)18-11-21(27)23(12-22(18)30)32-8-6-31(7-9-32)15(2)33/h4-5,10-12,14H,3,6-9H2,1-2H3,(H,29,35)