5-[[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-furan-2-carboxamide

Systemtic Name: 5-[[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-furan-2-carboxamide Openeye Name: 5-[[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-furan-2-carboxamide CAS Name: 5-[[1-(4-fluorophenyl)-2-(3-methyl-1-oxobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-2-furancarboxamide IUPAC Name: 5-[[1-(4-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenylfuran-2-carboxamide Traditional Name: 5-[[1-(4-fluorophenyl)-2-isovaleryl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-2-furamide Formula: C32H31FN2O4 MolecularWeight: 526.597943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OCC4=CC=C(O4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC(C)CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OCC4=CC=C(O4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C32H31FN2O4/c1-21(2)18-30(36)35-17-16-22-10-13-26(19-28(22)31(35)23-8-11-24(33)12-9-23)38-20-27-14-15-29(39-27)32(37)34-25-6-4-3-5-7-25/h3-15,19,21,31H,16-18,20H2,1-2H3,(H,34,37)