N-(4-bromanyl-2-fluoranyl-phenyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-esyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C18H18BrFN2O3S MolecularWeight: 441.314523

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C18H18BrFN2O3S/c1-2-26(24,25)22-9-3-4-12-10-13(5-8-17(12)22)18(23)21-16-7-6-14(19)11-15(16)20/h5-8,10-11H,2-4,9H2,1H3,(H,21,23)