N-(4-ethanoylphenyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-(4-ethanoylphenyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-(4-acetylphenyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-(4-acetylphenyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-(4-acetylphenyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-(4-acetylphenyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C24H21FN2O2 MolecularWeight: 388.434143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)N2CCC3=CC=CC=C3C2C4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)N2CCC3=CC=CC=C3C2C4=CC=C(C=C4)F

InChI

InChI=1S/C24H21FN2O2/c1-16(28)17-8-12-21(13-9-17)26-24(29)27-15-14-18-4-2-3-5-22(18)23(27)19-6-10-20(25)11-7-19/h2-13,23H,14-15H2,1H3,(H,26,29)