N-[3-chloranyl-4-(diethylcarbamoyl)phenyl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[3-chloranyl-4-(diethylcarbamoyl)phenyl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide Openeye Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-7-fluoro-2-methyl-quinoline-4-carboxamide CAS Name: N-[3-chloro-4-[diethylamino(oxo)methyl]phenyl]-7-fluoro-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-7-fluoro-2-methylquinoline-4-carboxamide Traditional Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-7-fluoro-2-methyl-cinchoninamide Formula: C22H21ClFN3O2 MolecularWeight: 413.872443

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=C2C=CC(=C3)F)C)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=C2C=CC(=C3)F)C)Cl

InChI

InChI=1S/C22H21ClFN3O2/c1-4-27(5-2)22(29)17-9-7-15(12-19(17)23)26-21(28)18-10-13(3)25-20-11-14(24)6-8-16(18)20/h6-12H,4-5H2,1-3H3,(H,26,28)