1-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-N,N-diethyl-2-oxidanylidene-quinoline-4-carboxamide

Systemtic Name: 1-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-N,N-diethyl-2-oxidanylidene-quinoline-4-carboxamide Openeye Name: 1-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]-N,N-diethyl-2-oxo-quinoline-4-carboxamide CAS Name: 1-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-N,N-diethyl-2-oxo-4-quinolinecarboxamide IUPAC Name: 1-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-N,N-diethyl-2-oxoquinoline-4-carboxamide Traditional Name: 1-[2-(3-chloro-4-fluoro-anilino)-2-keto-ethyl]-N,N-diethyl-2-keto-cinchoninamide Formula: C22H21ClFN3O3 MolecularWeight: 429.871843

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=O)N(C2=CC=CC=C21)CC(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=O)N(C2=CC=CC=C21)CC(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C22H21ClFN3O3/c1-3-26(4-2)22(30)16-12-21(29)27(19-8-6-5-7-15(16)19)13-20(28)25-14-9-10-18(24)17(23)11-14/h5-12H,3-4,13H2,1-2H3,(H,25,28)