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

Systemtic Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-furan-2-carboxamide Openeye Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-furan-2-carboxamide CAS Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-2-furancarboxamide IUPAC Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methylfuran-2-carboxamide Traditional Name: N-ethyl-5-[[1-(3-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-2-furamide Formula: C27H29FN2O4 MolecularWeight: 464.528563

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC(=CC=C3)F)C=C(C=C2)OCC4=CC=C(O4)C(=O)N(C)CC

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC(=CC=C3)F)C=C(C=C2)OCC4=CC=C(O4)C(=O)N(C)CC

InChI

InChI=1S/C27H29FN2O4/c1-4-25(31)30-14-13-18-9-10-21(16-23(18)26(30)19-7-6-8-20(28)15-19)33-17-22-11-12-24(34-22)27(32)29(3)5-2/h6-12,15-16,26H,4-5,13-14,17H2,1-3H3