1-[(4-cyano-2-fluoranyl-phenyl)methyl]-N-propan-2-yl-3,4-dihydro-2H-quinoline-5-carboxamide

Systemtic Name: 1-[(4-cyano-2-fluoranyl-phenyl)methyl]-N-propan-2-yl-3,4-dihydro-2H-quinoline-5-carboxamide Openeye Name: 1-[(4-cyano-2-fluoro-phenyl)methyl]-N-isopropyl-3,4-dihydro-2H-quinoline-5-carboxamide CAS Name: 1-[(4-cyano-2-fluorophenyl)methyl]-N-propan-2-yl-3,4-dihydro-2H-quinoline-5-carboxamide IUPAC Name: 1-[(4-cyano-2-fluorophenyl)methyl]-N-propan-2-yl-3,4-dihydro-2H-quinoline-5-carboxamide Traditional Name: 1-(4-cyano-2-fluoro-benzyl)-N-isopropyl-3,4-dihydro-2H-quinoline-5-carboxamide Formula: C21H22FN3O MolecularWeight: 351.417283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C2CCCN(C2=CC=C1)CC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

CC(C)NC(=O)C1=C2CCCN(C2=CC=C1)CC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C21H22FN3O/c1-14(2)24-21(26)18-5-3-7-20-17(18)6-4-10-25(20)13-16-9-8-15(12-23)11-19(16)22/h3,5,7-9,11,14H,4,6,10,13H2,1-2H3,(H,24,26)