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

Systemtic Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-furan-2-carboxamide Openeye Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-furan-2-carboxamide CAS Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-(3-methyl-1-oxobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-2-furancarboxamide IUPAC Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methylfuran-2-carboxamide Traditional Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-isovaleryl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-2-furamide Formula: C29H33FN2O4 MolecularWeight: 492.581723

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)C1=CC=C(O1)COC2=CC3=C(CCN(C3C4=CC(=CC=C4)F)C(=O)CC(C)C)C=C2

Isomeric SMILES

CCN(C)C(=O)C1=CC=C(O1)COC2=CC3=C(CCN(C3C4=CC(=CC=C4)F)C(=O)CC(C)C)C=C2

InChI

InChI=1S/C29H33FN2O4/c1-5-31(4)29(34)26-12-11-24(36-26)18-35-23-10-9-20-13-14-32(27(33)15-19(2)3)28(25(20)17-23)21-7-6-8-22(30)16-21/h6-12,16-17,19,28H,5,13-15,18H2,1-4H3