N-[4-(6-fluoranyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-phenyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[4-(6-fluoranyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-phenyl]-3,3-dimethyl-butanamide Openeye Name: N-[4-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-phenyl]-3,3-dimethyl-butanamide CAS Name: N-[4-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-2-methylphenyl]-3,3-dimethylbutanamide IUPAC Name: N-[4-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-2-methylphenyl]-3,3-dimethylbutanamide Traditional Name: N-[4-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-phenyl]-3,3-dimethyl-butyramide Formula: C22H27FN2O MolecularWeight: 354.460983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCC3=C(C2)C=CC(=C3)F)NC(=O)CC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCC3=C(C2)C=CC(=C3)F)NC(=O)CC(C)(C)C

InChI

InChI=1S/C22H27FN2O/c1-15-11-19(7-8-20(15)24-21(26)13-22(2,3)4)25-10-9-16-12-18(23)6-5-17(16)14-25/h5-8,11-12H,9-10,13-14H2,1-4H3,(H,24,26)