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

Systemtic Name: N-[7-cyano-5-(5-fluoranyl-2-methoxy-phenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]ethanamide Openeye Name: N-[7-cyano-5-(5-fluoro-2-methoxy-phenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]acetamide CAS Name: N-[7-cyano-5-(5-fluoro-2-methoxyphenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]acetamide IUPAC Name: N-[7-cyano-5-(5-fluoro-2-methoxyphenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]acetamide Traditional Name: N-[7-cyano-5-(5-fluoro-2-methoxy-phenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl]acetamide Formula: C20H20FN3O2 MolecularWeight: 353.390103

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2CN(CCC2=C(C=C1C#N)C3=C(C=CC(=C3)F)OC)C

Isomeric SMILES

CC(=O)NC1=C2CN(CCC2=C(C=C1C#N)C3=C(C=CC(=C3)F)OC)C

InChI

InChI=1S/C20H20FN3O2/c1-12(25)23-20-13(10-22)8-16(15-6-7-24(2)11-18(15)20)17-9-14(21)4-5-19(17)26-3/h4-5,8-9H,6-7,11H2,1-3H3,(H,23,25)