2-chloranyl-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]quinoline-4-carboxamide

Systemtic Name: 2-chloranyl-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]quinoline-4-carboxamide Openeye Name: 2-chloro-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]quinoline-4-carboxamide CAS Name: 2-chloro-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-4-quinolinecarboxamide IUPAC Name: 2-chloro-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]quinoline-4-carboxamide Traditional Name: 2-chloro-N-ethyl-N-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]cinchoninamide Formula: C21H19ClFN3O2 MolecularWeight: 399.845863

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)C2=CC(=NC3=CC=CC=C32)Cl

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)C2=CC(=NC3=CC=CC=C32)Cl

InChI

InChI=1S/C21H19ClFN3O2/c1-2-26(13-20(27)24-12-14-7-9-15(23)10-8-14)21(28)17-11-19(22)25-18-6-4-3-5-16(17)18/h3-11H,2,12-13H2,1H3,(H,24,27)