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

Systemtic Name: 5-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-prop-2-enyl-furan-2-carboxamide Openeye Name: N-allyl-5-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]furan-2-carboxamide CAS Name: 5-[[1-(3-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-prop-2-enyl-2-furancarboxamide IUPAC Name: 5-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-prop-2-enylfuran-2-carboxamide Traditional Name: N-allyl-5-[[1-(3-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-2-furamide Formula: C27H27FN2O4 MolecularWeight: 462.512683

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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)NCC=C

Isomeric SMILES

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

InChI

InChI=1S/C27H27FN2O4/c1-3-13-29-27(32)24-11-10-22(34-24)17-33-21-9-8-18-12-14-30(25(31)4-2)26(23(18)16-21)19-6-5-7-20(28)15-19/h3,5-11,15-16,26H,1,4,12-14,17H2,2H3,(H,29,32)