N-[7-cyano-5-(5-fluoranyl-2-methoxy-phenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]-N-ethanoyl-ethanamide

Systemtic Name: N-[7-cyano-5-(5-fluoranyl-2-methoxy-phenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]-N-ethanoyl-ethanamide Openeye Name: N-acetyl-N-[7-cyano-5-(5-fluoro-2-methoxy-phenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]acetamide CAS Name: N-acetyl-N-[7-cyano-5-(5-fluoro-2-methoxyphenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]acetamide IUPAC Name: N-acetyl-N-[7-cyano-5-(5-fluoro-2-methoxyphenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]acetamide Traditional Name: N-acetyl-N-[7-cyano-5-(5-fluoro-2-methoxy-phenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]acetamide Formula: C22H22FN3O3 MolecularWeight: 395.426783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=C2CN(CCC2=C(C=C1C#N)C3=C(C=CC(=C3)F)OC)C)C(=O)C

Isomeric SMILES

CC(=O)N(C1=C2CN(CCC2=C(C=C1C#N)C3=C(C=CC(=C3)F)OC)C)C(=O)C

InChI

InChI=1S/C22H22FN3O3/c1-13(27)26(14(2)28)22-15(11-24)9-18(17-7-8-25(3)12-20(17)22)19-10-16(23)5-6-21(19)29-4/h5-6,9-10H,7-8,12H2,1-4H3