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

Systemtic Name: 5-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-(3-methylbutyl)furan-2-carboxamide Openeye Name: 5-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-isopentyl-furan-2-carboxamide CAS Name: 5-[[1-(4-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-(3-methylbutyl)-2-furancarboxamide IUPAC Name: 5-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-(3-methylbutyl)furan-2-carboxamide Traditional Name: 5-[[1-(4-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-isoamyl-2-furamide Formula: C29H33FN2O4 MolecularWeight: 492.581723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H33FN2O4/c1-4-27(33)32-16-14-20-7-10-23(17-25(20)28(32)21-5-8-22(30)9-6-21)35-18-24-11-12-26(36-24)29(34)31-15-13-19(2)3/h5-12,17,19,28H,4,13-16,18H2,1-3H3,(H,31,34)